2107
1111
327
337
0.752941191196442
0.752941191196442
0.752941191196442
N(1)
1.39199995994568
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0.800000011920929
4.551
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C(2)
1.46200001239777
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0.180000007152557
0.0350000001490116
3.896
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C(3)
1.46200001239777
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3.697
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O(4)
1.33299994468689
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4.533
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C(5)
1.46200001239777
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4.874
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O(6)
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C(7)
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N(8)
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C(9)
1.46200001239777
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2.389
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C(10)
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2.676
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O(11)
1.33299994468689
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C(12)
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0.921
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O(13)
1.33299994468689
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C(14)
1.46200001239777
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0.670
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N(15)
1.39199995994568
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C(16)
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3.594
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C(17)
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3.034
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O(18)
1.33299994468689
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3.222
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C(19)
1.46200001239777
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0.0350000001490116
5.135
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S(20)
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N(21)
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C(22)
1.46200001239777
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1.780
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C(23)
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O(24)
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C(25)
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0.235
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S(26)
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N(27)
1.39199995994568
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C(28)
1.46200001239777
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0.0350000001490116
3.075
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C(29)
1.46200001239777
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2.288
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O(30)
1.33299994468689
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2.873
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C(31)
1.46200001239777
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3.379
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C(32)
1.46200001239777
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2.238
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C(33)
1.46200001239777
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2.135
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N(34)
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C(35)
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C(36)
1.46200001239777
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O(37)
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C(38)
1.46200001239777
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O(39)
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N(40)
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C(41)
1.46200001239777
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0.0350000001490116
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C(42)
1.46200001239777
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0.0350000001490116
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O(43)
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C(44)
1.46200001239777
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0.0350000001490116
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C(45)
1.46200001239777
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0.0350000001490116
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C(46)
1.46200001239777
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0.0350000001490116
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C(47)
1.46200001239777
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0.0350000001490116
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-8.331
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N(48)
1.39199995994568
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C(49)
1.46200001239777
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0.0350000001490116
-5.192
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C(50)
1.46200001239777
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0.0350000001490116
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O(51)
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0.200000002980232
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C(52)
1.46200001239777
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0.180000007152557
0.0350000001490116
-5.088
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C(53)
1.46200001239777
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0.180000007152557
0.0350000001490116
-5.568
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C(54)
1.46200001239777
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0.180000007152557
0.0350000001490116
-5.810
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N(55)
1.39199995994568
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0.800000011920929
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C(56)
1.46200001239777
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0.0350000001490116
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C(57)
1.46200001239777
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0.0350000001490116
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O(58)
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0.200000002980232
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C(59)
1.46200001239777
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0.180000007152557
0.0350000001490116
-1.545
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N(60)
1.39199995994568
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0.800000011920929
-3.291
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C(61)
1.46200001239777
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0.180000007152557
0.0350000001490116
-3.716
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C(62)
1.46200001239777
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0.0350000001490116
-5.250
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O(63)
1.33299994468689
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0.200000002980232
0.200000002980232
-5.701
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C(64)
1.46200001239777
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0.180000007152557
0.0350000001490116
-3.313
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C(65)
1.46200001239777
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0.180000007152557
0.0350000001490116
-3.791
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C(66)
1.46200001239777
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0.180000007152557
0.0350000001490116
-3.221
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N(67)
1.39199995994568
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0.200000002980232
0.800000011920929
-1.768
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C(68)
1.46200001239777
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0.180000007152557
0.0350000001490116
-1.019
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N(69)
1.39199995994568
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0.800000011920929
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N(70)
1.39199995994568
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0.800000011920929
0.267
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N(71)
1.39199995994568
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0.800000011920929
-6.002
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C(72)
1.46200001239777
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0.0350000001490116
-7.489
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C(73)
1.46200001239777
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-7.845
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O(74)
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0.200000002980232
-8.748
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C(75)
1.46200001239777
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0.180000007152557
0.0350000001490116
-8.169
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O(76)
1.33299994468689
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0.200000002980232
0.200000002980232
-7.923
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N(77)
1.39199995994568
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0.800000011920929
-7.194
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C(78)
1.46200001239777
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0.0350000001490116
-7.477
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C(79)
1.46200001239777
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0.0350000001490116
-7.075
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O(80)
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C(81)
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0.0350000001490116
-6.824
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C(82)
1.46200001239777
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O(83)
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N(84)
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N(85)
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0.800000011920929
-5.922
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C(86)
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0.0350000001490116
-5.459
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C(87)
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0.0350000001490116
-6.496
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O(88)
1.33299994468689
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C(89)
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-4.076
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C(90)
1.46200001239777
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0.0350000001490116
-3.446
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C(91)
1.46200001239777
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-3.727
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C(92)
1.46200001239777
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0.0350000001490116
-2.541
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C(93)
1.46200001239777
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0.0350000001490116
-3.143
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C(94)
1.46200001239777
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C(95)
1.46200001239777
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N(96)
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C(97)
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-8.000
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C(98)
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O(99)
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C(100)
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-8.303
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C(101)
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-7.091
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O(102)
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N(103)
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N(104)
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C(105)
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C(106)
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O(107)
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C(108)
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C(109)
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C(110)
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N(111)
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C(112)
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-8.837
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C(113)
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-8.866
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4.523
O(114)
1.33299994468689
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-9.172
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C(115)
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0.0350000001490116
-7.410
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S(116)
1.74100005626678
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N(117)
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-8.548
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C(118)
1.46200001239777
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0.310000002384186
0.180000007152557
0.0350000001490116
-8.507
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C(119)
1.46200001239777
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0.0350000001490116
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O(120)
1.33299994468689
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C(121)
1.46200001239777
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0.0350000001490116
-7.591
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C(122)
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-6.093
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C(123)
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N(124)
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C(125)
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N(126)
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N(127)
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N(128)
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C(129)
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C(130)
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O(131)
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C(132)
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C(133)
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C(134)
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C(135)
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N(136)
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C(137)
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C(138)
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O(139)
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C(140)
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C(141)
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C(142)
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N(143)
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C(144)
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C(145)
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O(146)
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N(147)
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C(148)
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-7.555
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C(149)
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O(150)
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C(151)
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O(152)
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C(153)
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N(154)
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C(155)
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-3.928
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C(156)
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O(157)
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C(158)
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-3.158
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C(159)
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C(160)
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N(161)
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C(162)
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C(163)
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O(164)
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C(165)
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C(166)
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C(167)
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O(168)
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O(169)
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N(170)
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C(171)
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C(172)
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O(173)
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C(174)
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N(175)
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C(176)
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C(177)
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O(178)
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C(179)
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C(180)
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C(181)
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C(182)
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N(183)
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C(184)
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C(185)
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O(186)
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C(187)
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S(188)
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N(189)
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C(190)
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C(191)
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O(192)
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C(193)
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N(194)
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C(195)
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C(196)
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O(197)
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C(198)
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O(199)
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C(200)
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N(201)
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C(202)
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C(203)
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O(204)
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C(205)
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C(206)
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C(207)
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C(208)
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C(209)
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C(210)
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C(211)
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O(212)
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N(213)
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C(214)
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C(215)
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O(216)
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C(217)
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O(218)
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C(219)
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N(220)
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C(221)
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C(222)
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O(223)
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N(224)
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C(225)
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C(226)
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O(227)
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C(228)
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S(229)
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N(230)
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C(231)
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C(232)
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O(233)
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0.738
C(234)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
6.036
-2.172
1.813
C(235)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
6.355
-1.965
0.281
C(236)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
6.178
-3.642
2.229
C(237)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
7.859
-2.281
-0.015
N(238)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
5.005
0.659
2.680
C(239)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
5.058
2.102
2.439
C(240)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
6.556
2.489
2.240
O(241)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
7.366
2.100
3.079
C(242)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
4.486
2.884
3.643
C(243)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
2.988
2.474
3.875
C(244)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
4.590
4.424
3.403
C(245)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
2.543
3.065
5.291
N(246)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
6.797
3.215
1.145
C(247)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.193
3.704
0.917
C(248)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.145
5.191
0.768
O(249)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
7.143
5.826
0.392
C(250)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.834
3.012
-0.351
C(251)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.060
3.425
-1.627
C(252)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.931
1.487
-0.133
C(253)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.726
3.034
-2.972
N(254)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
9.305
5.832
1.014
C(255)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.349
7.284
0.915
C(256)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.425
7.782
-0.543
O(257)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
9.001
8.923
-0.790
C(258)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
10.625
7.670
1.677
C(259)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
11.294
6.452
2.081
C(260)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
10.480
5.229
1.706
N(261)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
9.938
6.899
-1.395
C(262)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
10.095
7.334
-2.841
C(263)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.809
6.982
-3.580
O(264)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
7.746
6.725
-3.010
N(265)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
8.943
6.950
-4.915
C(266)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
7.840
6.712
-5.840
C(267)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.038
5.503
-6.720
O(268)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
7.104
5.236
-7.496
C(269)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
7.614
7.956
-6.711
N(270)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
9.133
4.789
-6.559
C(271)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.449
3.667
-7.456
C(272)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.420
2.351
-6.683
O(273)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
10.352
2.035
-5.943
C(274)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
10.888
3.894
-8.086
O(275)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
10.815
5.254
-8.630
C(276)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
11.171
2.856
-9.183
N(277)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
8.326
1.609
-6.922
C(278)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.210
0.323
-6.178
C(279)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.136
-0.700
-6.774
O(280)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
9.261
-0.744
-8.029
C(281)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
6.760
-0.190
-6.240
S(282)
1.74100005626678
0.580333352088928
0.800000011920929
0.800000011920929
0.300000011920929
5.570
0.914
-5.438
N(283)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
9.700
-1.564
-5.964
C(284)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
10.559
-2.641
-6.448
C(285)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.778
-3.710
-7.169
O(286)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
8.545
-3.855
-7.018
C(287)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
11.230
-3.176
-5.189
C(288)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
10.241
-2.877
-4.090
C(289)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.575
-1.549
-4.471
N(290)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
10.512
-4.519
-7.937
C(291)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.872
-5.567
-8.752
C(292)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.109
-6.639
-8.044
O(293)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
8.215
-7.312
-8.612
N(294)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
9.441
-6.867
-6.745
C(295)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.712
-7.886
-5.944
C(296)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
7.492
-7.262
-5.236
O(297)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
6.787
-8.001
-4.548
C(298)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
9.664
-8.670
-5.057
C(299)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
10.452
-7.852
-4.067
O(300)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
10.669
-6.648
-4.277
O(301)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
10.858
-8.490
-3.047
N(302)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
7.284
-5.977
-5.384
C(303)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
6.085
-5.284
-4.843
C(304)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
5.523
-4.461
-6.019
O(305)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
5.425
-3.223
-5.932
C(306)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
6.422
-4.355
-3.655
C(307)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
6.719
-5.203
-2.407
C(308)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.005
-5.696
-2.167
C(309)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
5.702
-5.487
-1.494
C(310)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
8.272
-6.441
-1.035
C(311)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
5.957
-6.254
-0.354
C(312)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
7.245
-6.756
-0.131
O(313)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
7.505
-7.492
0.986
N(314)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
5.182
-5.211
-7.058
C(315)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
4.867
-4.550
-8.346
C(316)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
3.421
-4.142
-8.537
O(317)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
3.100
-3.519
-9.587
C(318)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
5.268
-5.610
-9.421
N(319)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
2.587
-4.462
-7.563
C(320)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
1.133
-4.241
-7.659
C(321)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
0.672
-3.188
-6.683
O(322)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
1.445
-2.431
-6.091
C(323)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
0.422
-5.582
-7.494
C(324)
1.46200001239777
0.487333327531815
0.310000002384186
0.180000007152557
0.0350000001490116
0.908
-6.592
-8.520
O(325)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
1.545
-7.596
-8.171
N(326)
1.39199995994568
0.46399998664856
0.200000002980232
0.200000002980232
0.800000011920929
0.599
-6.288
-9.780
O(327)
1.33299994468689
0.44433331489563
0.800000011920929
0.200000002980232
0.200000002980232
-0.607
-3.144
-6.589
N(1)-C(2)
4.551
6.446
-0.732
3.896
5.640
-1.812
C(2)-C(3)
3.896
5.640
-1.812
3.697
4.236
-1.299
C(2)-C(5)
3.896
5.640
-1.812
4.874
5.586
-3.033
C(3)-O(4)
3.697
4.236
-1.299
4.533
3.788
-0.505
C(3)-N(8)
3.697
4.236
-1.299
2.617
3.600
-1.761
C(5)-O(6)
4.874
5.586
-3.033
5.053
6.996
-3.376
C(5)-C(7)
4.874
5.586
-3.033
4.490
4.645
-4.147
N(8)-C(9)
2.617
3.600
-1.761
2.389
2.196
-1.303
C(9)-C(10)
2.389
2.196
-1.303
2.676
1.259
-2.454
C(9)-C(12)
2.389
2.196
-1.303
0.921
2.018
-0.755
C(10)-O(11)
2.676
1.259
-2.454
2.395
1.573
-3.623
C(10)-N(15)
2.676
1.259
-2.454
3.229
0.110
-2.114
C(12)-O(13)
0.921
2.018
-0.755
0.069
2.434
-1.834
C(12)-C(14)
0.921
2.018
-0.755
0.670
3.041
0.408
N(15)-C(16)
3.229
0.110
-2.114
3.594
-0.932
-3.100
C(16)-C(17)
3.594
-0.932
-3.100
3.034
-2.240
-2.578
C(16)-C(19)
3.594
-0.932
-3.100
5.135
-1.041
-3.229
C(17)-O(18)
3.034
-2.240
-2.578
3.222
-2.532
-1.380
C(17)-N(21)
3.034
-2.240
-2.578
2.365
-3.041
-3.404
C(19)-S(20)
5.135
-1.041
-3.229
5.981
0.514
-3.518
S(20)-S(282)
5.981
0.514
-3.518
5.570
0.914
-5.438
N(21)-C(22)
2.365
-3.041
-3.404
1.780
-4.295
-2.875
C(22)-C(23)
1.780
-4.295
-2.875
2.392
-5.495
-3.590
C(22)-C(25)
1.780
-4.295
-2.875
0.235
-4.282
-3.022
C(23)-O(24)
2.392
-5.495
-3.590
2.759
-5.402
-4.790
C(23)-N(27)
2.392
-5.495
-3.590
2.457
-6.614
-2.917
C(25)-S(26)
0.235
-4.282
-3.022
-0.554
-2.994
-2.022
S(26)-S(229)
-0.554
-2.994
-2.022
-0.649
-3.919
-0.212
N(27)-C(28)
2.457
-6.614
-2.917
3.075
-7.820
-3.448
N(27)-C(33)
2.457
-6.614
-2.917
2.135
-6.766
-1.451
C(28)-C(29)
3.075
-7.820
-3.448
2.288
-8.589
-4.462
C(28)-C(31)
3.075
-7.820
-3.448
3.379
-8.680
-2.178
C(29)-O(30)
2.288
-8.589
-4.462
2.873
-9.431
-5.158
C(29)-N(34)
2.288
-8.589
-4.462
0.969
-8.364
-4.525
C(31)-C(32)
3.379
-8.680
-2.178
2.238
-8.295
-1.235
C(32)-C(33)
2.238
-8.295
-1.235
2.135
-6.766
-1.451
N(34)-C(35)
0.969
-8.364
-4.525
0.103
-9.073
-5.474
C(35)-C(36)
0.103
-9.073
-5.474
-1.154
-8.240
-5.680
C(35)-C(38)
0.103
-9.073
-5.474
-0.280
-10.474
-5.005
C(36)-O(37)
-1.154
-8.240
-5.680
-1.388
-7.281
-4.903
C(36)-N(40)
-1.154
-8.240
-5.680
-1.924
-8.576
-6.719
C(38)-O(39)
-0.280
-10.474
-5.005
-1.166
-10.360
-3.874
N(40)-C(41)
-1.924
-8.576
-6.719
-3.195
-7.855
-6.965
C(41)-C(42)
-3.195
-7.855
-6.965
-4.162
-8.083
-5.803
C(41)-C(44)
-3.195
-7.855
-6.965
-3.772
-8.409
-8.332
C(42)-O(43)
-4.162
-8.083
-5.803
-4.795
-7.058
-5.416
C(42)-N(48)
-4.162
-8.083
-5.803
-4.286
-9.264
-5.274
C(44)-C(45)
-3.772
-8.409
-8.332
-2.884
-7.786
-9.448
C(44)-C(46)
-3.772
-8.409
-8.332
-5.282
-8.086
-8.460
C(45)-C(47)
-2.884
-7.786
-9.448
-3.162
-8.331
-10.869
N(48)-C(49)
-4.286
-9.264
-5.274
-5.192
-9.510
-4.115
C(49)-C(50)
-5.192
-9.510
-4.115
-4.833
-8.578
-2.950
C(49)-C(52)
-5.192
-9.510
-4.115
-5.088
-10.987
-3.663
C(50)-O(51)
-4.833
-8.578
-2.950
-5.676
-8.002
-2.300
C(50)-N(55)
-4.833
-8.578
-2.950
-3.508
-8.471
-2.693
C(52)-C(53)
-5.088
-10.987
-3.663
-5.568
-11.212
-2.243
C(52)-C(54)
-5.088
-10.987
-3.663
-5.810
-11.902
-4.651
N(55)-C(56)
-3.508
-8.471
-2.693
-3.036
-7.621
-1.561
C(56)-C(57)
-3.036
-7.621
-1.561
-3.451
-6.186
-1.795
C(56)-C(59)
-3.036
-7.621
-1.561
-1.545
-7.804
-1.357
C(57)-O(58)
-3.451
-6.186
-1.795
-3.877
-5.502
-0.852
C(57)-N(60)
-3.451
-6.186
-1.795
-3.291
-5.665
-3.045
N(60)-C(61)
-3.291
-5.665
-3.045
-3.716
-4.286
-3.347
C(61)-C(62)
-3.716
-4.286
-3.347
-5.250
-4.119
-3.176
C(61)-C(64)
-3.716
-4.286
-3.347
-3.313
-3.915
-4.794
C(62)-O(63)
-5.250
-4.119
-3.176
-5.701
-3.093
-2.648
C(62)-N(71)
-5.250
-4.119
-3.176
-6.002
-5.093
-3.666
C(64)-C(65)
-3.313
-3.915
-4.794
-3.791
-2.528
-5.211
C(65)-C(66)
-3.791
-2.528
-5.211
-3.221
-1.367
-4.460
C(66)-N(67)
-3.221
-1.367
-4.460
-1.768
-1.288
-4.792
N(67)-C(68)
-1.768
-1.288
-4.792
-1.019
-0.293
-4.289
C(68)-N(69)
-1.019
-0.293
-4.289
-1.519
0.622
-3.442
C(68)-N(70)
-1.019
-0.293
-4.289
0.267
-0.258
-4.665
N(71)-C(72)
-6.002
-5.093
-3.666
-7.489
-4.982
-3.532
C(72)-C(73)
-7.489
-4.982
-3.532
-7.845
-4.937
-2.022
C(72)-C(75)
-7.489
-4.982
-3.532
-8.169
-6.165
-4.199
C(73)-O(74)
-7.845
-4.937
-2.022
-8.748
-4.142
-1.639
C(73)-N(77)
-7.845
-4.937
-2.022
-7.194
-5.775
-1.234
C(75)-O(76)
-8.169
-6.165
-4.199
-7.923
-6.093
-5.620
N(77)-C(78)
-7.194
-5.775
-1.234
-7.477
-5.792
0.245
C(78)-C(79)
-7.477
-5.792
0.245
-7.075
-4.485
0.883
C(78)-C(81)
-7.477
-5.792
0.245
-6.824
-6.991
0.923
C(79)-O(80)
-7.075
-4.485
0.883
-7.756
-3.976
1.766
C(79)-N(85)
-7.075
-4.485
0.883
-5.922
-3.925
0.433
C(81)-C(82)
-6.824
-6.991
0.923
-7.478
-8.331
0.539
C(82)-O(83)
-7.478
-8.331
0.539
-8.638
-8.302
0.130
C(82)-N(84)
-7.478
-8.331
0.539
-6.700
-9.400
0.699
N(85)-C(86)
-5.922
-3.925
0.433
-5.459
-2.646
0.922
C(86)-C(87)
-5.459
-2.646
0.922
-6.496
-1.561
0.649
C(86)-C(89)
-5.459
-2.646
0.922
-4.076
-2.325
0.250
C(87)-O(88)
-6.496
-1.561
0.649
-6.777
-0.698
1.521
C(87)-N(96)
-6.496
-1.561
0.649
-7.015
-1.528
-0.589
C(89)-C(90)
-4.076
-2.325
0.250
-3.446
-1.065
0.788
C(90)-C(91)
-3.446
-1.065
0.788
-3.727
0.160
0.175
C(90)-C(92)
-3.446
-1.065
0.788
-2.541
-1.147
1.872
C(91)-C(93)
-3.727
0.160
0.175
-3.143
1.353
0.690
C(92)-C(94)
-2.541
-1.147
1.872
-1.997
0.037
2.366
C(93)-C(95)
-3.143
1.353
0.690
-2.314
1.222
1.779
C(94)-C(95)
-1.997
0.037
2.366
-2.314
1.222
1.779
N(96)-C(97)
-7.015
-1.528
-0.589
-8.000
-0.455
-0.922
C(97)-C(98)
-8.000
-0.455
-0.922
-9.277
-0.577
-0.052
C(97)-C(100)
-8.000
-0.455
-0.922
-8.303
-0.492
-2.411
C(98)-O(99)
-9.277
-0.577
-0.052
-9.885
0.445
0.296
C(98)-N(104)
-9.277
-0.577
-0.052
-9.662
-1.816
0.245
C(100)-C(101)
-8.303
-0.492
-2.411
-7.091
0.058
-3.224
C(101)-O(102)
-7.091
0.058
-3.224
-6.319
0.814
-2.689
C(101)-N(103)
-7.091
0.058
-3.224
-7.101
-0.364
-4.492
N(104)-C(105)
-9.662
-1.816
0.245
-10.862
-1.962
1.139
C(105)-C(106)
-10.862
-1.962
1.139
-10.506
-1.490
2.570
C(105)-C(108)
-10.862
-1.962
1.139
-11.395
-3.396
1.093
C(106)-O(107)
-10.506
-1.490
2.570
-11.298
-0.784
3.221
C(106)-N(111)
-10.506
-1.490
2.570
-9.310
-1.859
3.008
C(108)-C(109)
-11.395
-3.396
1.093
-12.479
-3.595
2.175
C(108)-C(110)
-11.395
-3.396
1.093
-12.036
-3.633
-0.298
N(111)-C(112)
-9.310
-1.859
3.008
-8.837
-1.461
4.365
C(112)-C(113)
-8.837
-1.461
4.365
-8.866
0.035
4.523
C(112)-C(115)
-8.837
-1.461
4.365
-7.410
-2.068
4.549
C(113)-O(114)
-8.866
0.035
4.523
-9.172
0.593
5.581
C(113)-N(117)
-8.866
0.035
4.523
-8.548
0.769
3.422
C(115)-S(116)
-7.410
-2.068
4.549
-6.701
-1.649
6.163
S(116)-S(188)
-6.701
-1.649
6.163
-5.633
0.051
5.745
N(117)-C(118)
-8.548
0.769
3.422
-8.507
2.223
3.434
C(118)-C(119)
-8.507
2.223
3.434
-9.863
2.913
3.389
C(118)-C(121)
-8.507
2.223
3.434
-7.591
2.752
2.298
C(119)-O(120)
-9.863
2.913
3.389
-9.939
4.117
3.713
C(119)-N(128)
-9.863
2.913
3.389
-10.921
2.157
3.008
C(121)-C(122)
-7.591
2.752
2.298
-6.093
2.417
2.483
C(122)-C(123)
-6.093
2.417
2.483
-5.465
3.391
3.469
C(123)-N(124)
-5.465
3.391
3.469
-5.327
4.709
2.862
N(124)-C(125)
-5.327
4.709
2.862
-5.225
5.861
3.512
C(125)-N(126)
-5.225
5.861
3.512
-5.313
5.918
4.850
C(125)-N(127)
-5.225
5.861
3.512
-4.927
6.985
2.844
N(128)-C(129)
-10.921
2.157
3.008
-12.260
2.806
2.876
C(129)-C(130)
-12.260
2.806
2.876
-12.715
3.573
4.103
C(129)-C(132)
-12.260
2.806
2.876
-13.284
1.804
2.365
C(130)-O(131)
-12.715
3.573
4.103
-13.174
4.723
3.957
C(130)-N(136)
-12.715
3.573
4.103
-12.576
2.982
5.281
C(132)-C(133)
-13.284
1.804
2.365
-13.252
1.438
0.874
C(133)-C(134)
-13.252
1.438
0.874
-14.347
0.351
0.719
C(133)-C(135)
-13.252
1.438
0.874
-13.540
2.667
0.036
N(136)-C(137)
-12.576
2.982
5.281
-13.012
3.717
6.492
N(136)-C(142)
-12.576
2.982
5.281
-12.308
1.568
5.533
C(137)-C(138)
-13.012
3.717
6.492
-12.061
4.781
6.944
C(137)-C(140)
-13.012
3.717
6.492
-13.203
2.649
7.558
C(138)-O(139)
-12.061
4.781
6.944
-12.376
5.523
7.900
C(138)-N(143)
-12.061
4.781
6.944
-10.859
4.872
6.334
C(140)-C(141)
-13.203
2.649
7.558
-12.579
1.407
7.032
C(141)-C(142)
-12.579
1.407
7.032
-12.308
1.568
5.533
N(143)-C(144)
-10.859
4.872
6.334
-9.881
5.894
6.735
C(144)-C(145)
-9.881
5.894
6.735
-8.717
5.300
7.529
C(145)-O(146)
-8.717
5.300
7.529
-7.943
6.131
8.029
C(145)-N(147)
-8.717
5.300
7.529
-8.611
3.999
7.649
N(147)-C(148)
-8.611
3.999
7.649
-7.555
3.344
8.397
C(148)-C(149)
-7.555
3.344
8.397
-6.175
3.863
7.915
C(148)-C(151)
-7.555
3.344
8.397
-7.571
1.806
8.134
C(149)-O(150)
-6.175
3.863
7.915
-5.973
3.929
6.691
C(149)-N(154)
-6.175
3.863
7.915
-5.294
4.140
8.849
C(151)-O(152)
-7.571
1.806
8.134
-8.966
1.380
8.219
C(151)-C(153)
-7.571
1.806
8.134
-6.702
1.014
9.111
N(154)-C(155)
-5.294
4.140
8.849
-3.928
4.608
8.429
N(154)-C(160)
-5.294
4.140
8.849
-5.422
4.152
10.315
C(155)-C(156)
-3.928
4.608
8.429
-3.286
3.579
7.514
C(155)-C(158)
-3.928
4.608
8.429
-3.158
4.737
9.753
C(156)-O(157)
-3.286
3.579
7.514
-3.403
2.339
7.676
C(156)-N(161)
-3.286
3.579
7.514
-2.492
4.163
6.572
C(158)-C(159)
-3.158
4.737
9.753
-4.212
4.934
10.787
C(159)-C(160)
-4.212
4.934
10.787
-5.422
4.152
10.315
N(161)-C(162)
-2.492
4.163
6.572
-1.753
3.265
5.648
C(162)-C(163)
-1.753
3.265
5.648
-0.887
2.288
6.381
C(162)-C(165)
-1.753
3.265
5.648
-0.850
4.106
4.704
C(163)-O(164)
-0.887
2.288
6.381
-0.788
1.112
5.948
C(163)-N(170)
-0.887
2.288
6.381
-0.271
2.696
7.516
C(165)-C(166)
-0.850
4.106
4.704
-1.677
4.870
3.638
C(166)-C(167)
-1.677
4.870
3.638
-0.783
5.543
2.582
C(167)-O(168)
-0.783
5.543
2.582
0.357
5.770
2.850
C(167)-O(169)
-0.783
5.543
2.582
-1.380
5.816
1.512
N(170)-C(171)
-0.271
2.696
7.516
0.663
1.747
8.185
C(171)-C(172)
0.663
1.747
8.185
-0.030
0.492
8.684
C(171)-C(174)
0.663
1.747
8.185
1.348
2.472
9.347
C(172)-O(173)
-0.030
0.492
8.684
0.520
-0.624
8.675
C(172)-N(175)
-0.030
0.492
8.684
-1.304
0.663
9.143
N(175)-C(176)
-1.304
0.663
9.143
-2.057
-0.512
9.627
C(176)-C(177)
-2.057
-0.512
9.627
-2.536
-1.389
8.461
C(176)-C(179)
-2.057
-0.512
9.627
-3.284
-0.078
10.523
C(177)-O(178)
-2.536
-1.389
8.461
-2.504
-2.602
8.528
C(177)-N(183)
-2.536
-1.389
8.461
-2.929
-0.688
7.396
C(179)-C(180)
-3.284
-0.078
10.523
-2.708
0.361
11.925
C(179)-C(181)
-3.284
-0.078
10.523
-4.266
-1.262
10.734
C(180)-C(182)
-2.708
0.361
11.925
-2.211
-0.864
12.743
N(183)-C(184)
-2.929
-0.688
7.396
-3.327
-1.463
6.171
C(184)-C(185)
-3.327
-1.463
6.171
-2.128
-2.221
5.593
C(184)-C(187)
-3.327
-1.463
6.171
-4.030
-0.595
5.186
C(185)-O(186)
-2.128
-2.221
5.593
-2.348
-3.314
5.041
C(185)-N(189)
-2.128
-2.221
5.593
-0.939
-1.659
5.746
C(187)-S(188)
-4.030
-0.595
5.186
-5.633
0.051
5.745
N(189)-C(190)
-0.939
-1.659
5.746
0.300
-2.331
5.248
C(190)-C(191)
0.300
-2.331
5.248
0.498
-3.655
5.957
C(190)-C(193)
0.300
-2.331
5.248
1.476
-1.396
5.397
C(191)-O(192)
0.498
-3.655
5.957
0.634
-4.721
5.311
C(191)-N(194)
0.498
-3.655
5.957
0.510
-3.641
7.309
N(194)-C(195)
0.510
-3.641
7.309
0.729
-4.920
8.004
C(195)-C(196)
0.729
-4.920
8.004
-0.416
-5.896
7.866
C(195)-C(198)
0.729
-4.920
8.004
1.086
-4.700
9.535
C(196)-O(197)
-0.416
-5.896
7.866
-0.239
-7.145
7.929
C(196)-N(201)
-0.416
-5.896
7.866
-1.598
-5.355
7.638
C(198)-O(199)
1.086
-4.700
9.535
0.029
-3.867
10.081
C(198)-C(200)
1.086
-4.700
9.535
2.449
-4.012
9.692
N(201)-C(202)
-1.598
-5.355
7.638
-2.780
-6.198
7.425
C(202)-C(203)
-2.780
-6.198
7.425
-2.700
-6.989
6.113
C(202)-C(205)
-2.780
-6.198
7.425
-4.034
-5.263
7.379
C(203)-O(204)
-2.700
-6.989
6.113
-3.077
-8.145
6.058
C(203)-N(213)
-2.700
-6.989
6.113
-2.112
-6.330
5.073
C(205)-C(206)
-4.034
-5.263
7.379
-5.326
-6.055
7.218
C(206)-C(207)
-5.326
-6.055
7.218
-5.566
-7.056
8.175
C(206)-C(208)
-5.326
-6.055
7.218
-6.234
-5.815
6.211
C(207)-C(209)
-5.566
-7.056
8.175
-6.724
-7.813
8.125
C(208)-C(210)
-6.234
-5.815
6.211
-7.427
-6.626
6.156
C(209)-C(211)
-6.724
-7.813
8.125
-7.621
-7.569
7.098
C(210)-C(211)
-7.427
-6.626
6.156
-7.621
-7.569
7.098
C(211)-O(212)
-7.621
-7.569
7.098
-8.786
-8.363
7.116
N(213)-C(214)
-2.112
-6.330
5.073
-2.137
-6.909
3.723
C(214)-C(215)
-2.137
-6.909
3.723
-0.840
-7.444
3.159
C(214)-C(217)
-2.137
-6.909
3.723
-2.671
-5.817
2.708
C(215)-O(216)
-0.840
-7.444
3.159
-0.878
-8.212
2.174
C(215)-N(220)
-0.840
-7.444
3.159
0.267
-7.030
3.733
C(217)-O(218)
-2.671
-5.817
2.708
-1.716
-4.723
2.781
C(217)-C(219)
-2.671
-5.817
2.708
-4.104
-5.369
3.036
N(220)-C(221)
0.267
-7.030
3.733
1.602
-7.332
3.165
C(221)-C(222)
1.602
-7.332
3.165
2.072
-6.241
2.231
C(222)-O(223)
2.072
-6.241
2.231
3.222
-6.344
1.726
C(222)-N(224)
2.072
-6.241
2.231
1.266
-5.192
1.962
N(224)-C(225)
1.266
-5.192
1.962
1.776
-4.032
1.206
C(225)-C(226)
1.776
-4.032
1.206
2.796
-3.256
2.081
C(225)-C(228)
1.776
-4.032
1.206
0.640
-3.107
0.734
C(226)-O(227)
2.796
-3.256
2.081
2.852
-3.489
3.309
C(226)-N(230)
2.796
-3.256
2.081
3.558
-2.400
1.425
C(228)-S(229)
0.640
-3.107
0.734
-0.649
-3.919
-0.212
N(230)-C(231)
3.558
-2.400
1.425
4.603
-1.622
2.123
C(231)-C(232)
4.603
-1.622
2.123
4.466
-0.148
1.775
C(231)-C(234)
4.603
-1.622
2.123
6.036
-2.172
1.813
C(232)-O(233)
4.466
-0.148
1.775
3.853
0.216
0.738
C(232)-N(238)
4.466
-0.148
1.775
5.005
0.659
2.680
C(234)-C(235)
6.036
-2.172
1.813
6.355
-1.965
0.281
C(234)-C(236)
6.036
-2.172
1.813
6.178
-3.642
2.229
C(235)-C(237)
6.355
-1.965
0.281
7.859
-2.281
-0.015
N(238)-C(239)
5.005
0.659
2.680
5.058
2.102
2.439
C(239)-C(240)
5.058
2.102
2.439
6.556
2.489
2.240
C(239)-C(242)
5.058
2.102
2.439
4.486
2.884
3.643
C(240)-O(241)
6.556
2.489
2.240
7.366
2.100
3.079
C(240)-N(246)
6.556
2.489
2.240
6.797
3.215
1.145
C(242)-C(243)
4.486
2.884
3.643
2.988
2.474
3.875
C(242)-C(244)
4.486
2.884
3.643
4.590
4.424
3.403
C(243)-C(245)
2.988
2.474
3.875
2.543
3.065
5.291
N(246)-C(247)
6.797
3.215
1.145
8.193
3.704
0.917
C(247)-C(248)
8.193
3.704
0.917
8.145
5.191
0.768
C(247)-C(250)
8.193
3.704
0.917
8.834
3.012
-0.351
C(248)-O(249)
8.145
5.191
0.768
7.143
5.826
0.392
C(248)-N(254)
8.145
5.191
0.768
9.305
5.832
1.014
C(250)-C(251)
8.834
3.012
-0.351
8.060
3.425
-1.627
C(250)-C(252)
8.834
3.012
-0.351
8.931
1.487
-0.133
C(251)-C(253)
8.060
3.425
-1.627
8.726
3.034
-2.972
N(254)-C(255)
9.305
5.832
1.014
9.349
7.284
0.915
N(254)-C(260)
9.305
5.832
1.014
10.480
5.229
1.706
C(255)-C(256)
9.349
7.284
0.915
9.425
7.782
-0.543
C(255)-C(258)
9.349
7.284
0.915
10.625
7.670
1.677
C(256)-O(257)
9.425
7.782
-0.543
9.001
8.923
-0.790
C(256)-N(261)
9.425
7.782
-0.543
9.938
6.899
-1.395
C(258)-C(259)
10.625
7.670
1.677
11.294
6.452
2.081
C(259)-C(260)
11.294
6.452
2.081
10.480
5.229
1.706
N(261)-C(262)
9.938
6.899
-1.395
10.095
7.334
-2.841
C(262)-C(263)
10.095
7.334
-2.841
8.809
6.982
-3.580
C(263)-O(264)
8.809
6.982
-3.580
7.746
6.725
-3.010
C(263)-N(265)
8.809
6.982
-3.580
8.943
6.950
-4.915
N(265)-C(266)
8.943
6.950
-4.915
7.840
6.712
-5.840
C(266)-C(267)
7.840
6.712
-5.840
8.038
5.503
-6.720
C(266)-C(269)
7.840
6.712
-5.840
7.614
7.956
-6.711
C(267)-O(268)
8.038
5.503
-6.720
7.104
5.236
-7.496
C(267)-N(270)
8.038
5.503
-6.720
9.133
4.789
-6.559
N(270)-C(271)
9.133
4.789
-6.559
9.449
3.667
-7.456
C(271)-C(272)
9.449
3.667
-7.456
9.420
2.351
-6.683
C(271)-C(274)
9.449
3.667
-7.456
10.888
3.894
-8.086
C(272)-O(273)
9.420
2.351
-6.683
10.352
2.035
-5.943
C(272)-N(277)
9.420
2.351
-6.683
8.326
1.609
-6.922
C(274)-O(275)
10.888
3.894
-8.086
10.815
5.254
-8.630
C(274)-C(276)
10.888
3.894
-8.086
11.171
2.856
-9.183
N(277)-C(278)
8.326
1.609
-6.922
8.210
0.323
-6.178
C(278)-C(279)
8.210
0.323
-6.178
9.136
-0.700
-6.774
C(278)-C(281)
8.210
0.323
-6.178
6.760
-0.190
-6.240
C(279)-O(280)
9.136
-0.700
-6.774
9.261
-0.744
-8.029
C(279)-N(283)
9.136
-0.700
-6.774
9.700
-1.564
-5.964
C(281)-S(282)
6.760
-0.190
-6.240
5.570
0.914
-5.438
N(283)-C(284)
9.700
-1.564
-5.964
10.559
-2.641
-6.448
N(283)-C(289)
9.700
-1.564
-5.964
9.575
-1.549
-4.471
C(284)-C(285)
10.559
-2.641
-6.448
9.778
-3.710
-7.169
C(284)-C(287)
10.559
-2.641
-6.448
11.230
-3.176
-5.189
C(285)-O(286)
9.778
-3.710
-7.169
8.545
-3.855
-7.018
C(285)-N(290)
9.778
-3.710
-7.169
10.512
-4.519
-7.937
C(287)-C(288)
11.230
-3.176
-5.189
10.241
-2.877
-4.090
C(288)-C(289)
10.241
-2.877
-4.090
9.575
-1.549
-4.471
N(290)-C(291)
10.512
-4.519
-7.937
9.872
-5.567
-8.752
C(291)-C(292)
9.872
-5.567
-8.752
9.109
-6.639
-8.044
C(292)-O(293)
9.109
-6.639
-8.044
8.215
-7.312
-8.612
C(292)-N(294)
9.109
-6.639
-8.044
9.441
-6.867
-6.745
N(294)-C(295)
9.441
-6.867
-6.745
8.712
-7.886
-5.944
C(295)-C(296)
8.712
-7.886
-5.944
7.492
-7.262
-5.236
C(295)-C(298)
8.712
-7.886
-5.944
9.664
-8.670
-5.057
C(296)-O(297)
7.492
-7.262
-5.236
6.787
-8.001
-4.548
C(296)-N(302)
7.492
-7.262
-5.236
7.284
-5.977
-5.384
C(298)-C(299)
9.664
-8.670
-5.057
10.452
-7.852
-4.067
C(299)-O(300)
10.452
-7.852
-4.067
10.669
-6.648
-4.277
C(299)-O(301)
10.452
-7.852
-4.067
10.858
-8.490
-3.047
N(302)-C(303)
7.284
-5.977
-5.384
6.085
-5.284
-4.843
C(303)-C(304)
6.085
-5.284
-4.843
5.523
-4.461
-6.019
C(303)-C(306)
6.085
-5.284
-4.843
6.422
-4.355
-3.655
C(304)-O(305)
5.523
-4.461
-6.019
5.425
-3.223
-5.932
C(304)-N(314)
5.523
-4.461
-6.019
5.182
-5.211
-7.058
C(306)-C(307)
6.422
-4.355
-3.655
6.719
-5.203
-2.407
C(307)-C(308)
6.719
-5.203
-2.407
8.005
-5.696
-2.167
C(307)-C(309)
6.719
-5.203
-2.407
5.702
-5.487
-1.494
C(308)-C(310)
8.005
-5.696
-2.167
8.272
-6.441
-1.035
C(309)-C(311)
5.702
-5.487
-1.494
5.957
-6.254
-0.354
C(310)-C(312)
8.272
-6.441
-1.035
7.245
-6.756
-0.131
C(311)-C(312)
5.957
-6.254
-0.354
7.245
-6.756
-0.131
C(312)-O(313)
7.245
-6.756
-0.131
7.505
-7.492
0.986
N(314)-C(315)
5.182
-5.211
-7.058
4.867
-4.550
-8.346
C(315)-C(316)
4.867
-4.550
-8.346
3.421
-4.142
-8.537
C(315)-C(318)
4.867
-4.550
-8.346
5.268
-5.610
-9.421
C(316)-O(317)
3.421
-4.142
-8.537
3.100
-3.519
-9.587
C(316)-N(319)
3.421
-4.142
-8.537
2.587
-4.462
-7.563
N(319)-C(320)
2.587
-4.462
-7.563
1.133
-4.241
-7.659
C(320)-C(321)
1.133
-4.241
-7.659
0.672
-3.188
-6.683
C(320)-C(323)
1.133
-4.241
-7.659
0.422
-5.582
-7.494
C(321)-O(322)
0.672
-3.188
-6.683
1.445
-2.431
-6.091
C(321)-O(327)
0.672
-3.188
-6.683
-0.607
-3.144
-6.589
C(323)-C(324)
0.422
-5.582
-7.494
0.908
-6.592
-8.520
C(324)-O(325)
0.908
-6.592
-8.520
1.545
-7.596
-8.171
C(324)-N(326)
0.908
-6.592
-8.520
0.599
-6.288
-9.780
