2107
һӫ
37
41
0.796078443527222
0.886274516582489
0.152941182255745
C(1)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-1.640
2.959
1.211
C(2)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-2.848
2.425
1.735
C(3)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-2.957
1.032
1.987
C(4)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-1.860
0.173
1.716
C(5)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.653
0.707
1.193
C(6)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.543
2.100
0.941
O(7)
1.33299994468689
0.333249986171722
0.800000011920929
0.200000002980232
0.200000002980232
-3.899
3.244
1.983
I(9)
2.11700010299683
0.529250025749207
0.560000002384186
0.200000002980232
0.560000002384186
-1.468
5.070
0.847
O(10)
1.33299994468689
0.333249986171722
0.800000011920929
0.200000002980232
0.200000002980232
0.561
2.699
0.432
C(11)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
0.480
-0.229
0.907
C(12)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
1.462
0.439
-0.004
C(13)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
2.443
-0.359
-0.649
C(14)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
3.396
0.246
-1.511
C(15)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
3.247
1.625
-1.868
C(16)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
2.327
2.435
-1.151
C(17)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
1.435
1.843
-0.219
I(18)
2.11700010299683
0.529250025749207
0.560000002384186
0.200000002980232
0.560000002384186
2.273
4.557
-1.491
O(19)
1.33299994468689
0.333249986171722
0.800000011920929
0.200000002980232
0.200000002980232
3.575
2.679
-2.653
C(21)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.048
-1.466
0.250
C(22)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.736
-1.597
-0.985
C(23)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-1.170
-2.876
-1.424
C(24)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.916
-4.024
-0.627
C(25)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.228
-3.892
0.609
C(26)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
0.206
-2.613
1.047
C(27)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
0.937
-2.239
2.322
O(28)
1.33299994468689
0.333249986171722
0.800000011920929
0.200000002980232
0.200000002980232
1.438
-2.662
3.337
O(29)
1.33299994468689
0.333249986171722
0.800000011920929
0.200000002980232
0.200000002980232
1.030
-0.681
2.115
H(30)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-3.896
0.618
2.384
H(37)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-1.948
-0.907
1.903
H(8)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-3.639
4.149
1.742
H(36)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
2.458
-1.447
-0.490
H(35)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
4.304
0.178
-2.128
H(20)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
4.235
2.378
-3.300
H(34)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-0.924
-0.710
-1.607
H(33)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-1.694
-2.979
-2.385
H(31)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-1.244
-5.016
-0.971
H(32)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-0.024
-4.783
1.222
C(1)-C(2)
-1.640
2.959
1.211
-2.848
2.425
1.735
C(1)-C(6)
-1.640
2.959
1.211
-0.543
2.100
0.941
C(1)-I(9)
-1.640
2.959
1.211
-1.468
5.070
0.847
C(2)-C(3)
-2.848
2.425
1.735
-2.957
1.032
1.987
C(2)-O(7)
-2.848
2.425
1.735
-3.899
3.244
1.983
C(3)-C(4)
-2.957
1.032
1.987
-1.860
0.173
1.716
C(3)-H(30)
-2.957
1.032
1.987
-3.896
0.618
2.384
C(4)-C(5)
-1.860
0.173
1.716
-0.653
0.707
1.193
C(4)-H(37)
-1.860
0.173
1.716
-1.948
-0.907
1.903
C(5)-C(6)
-0.653
0.707
1.193
-0.543
2.100
0.941
C(5)-C(11)
-0.653
0.707
1.193
0.480
-0.229
0.907
C(6)-O(10)
-0.543
2.100
0.941
0.561
2.699
0.432
O(7)-H(8)
-3.899
3.244
1.983
-3.639
4.149
1.742
O(10)-C(17)
0.561
2.699
0.432
1.435
1.843
-0.219
C(11)-C(12)
0.480
-0.229
0.907
1.462
0.439
-0.004
C(11)-C(21)
0.480
-0.229
0.907
-0.048
-1.466
0.250
C(11)-O(29)
0.480
-0.229
0.907
1.030
-0.681
2.115
C(12)-C(13)
1.462
0.439
-0.004
2.443
-0.359
-0.649
C(12)-C(17)
1.462
0.439
-0.004
1.435
1.843
-0.219
C(13)-C(14)
2.443
-0.359
-0.649
3.396
0.246
-1.511
C(13)-H(36)
2.443
-0.359
-0.649
2.458
-1.447
-0.490
C(14)-C(15)
3.396
0.246
-1.511
3.247
1.625
-1.868
C(14)-H(35)
3.396
0.246
-1.511
4.304
0.178
-2.128
C(15)-C(16)
3.247
1.625
-1.868
2.327
2.435
-1.151
C(15)-O(19)
3.247
1.625
-1.868
3.575
2.679
-2.653
C(16)-C(17)
2.327
2.435
-1.151
1.435
1.843
-0.219
C(16)-I(18)
2.327
2.435
-1.151
2.273
4.557
-1.491
O(19)-H(20)
3.575
2.679
-2.653
4.235
2.378
-3.300
C(21)-C(22)
-0.048
-1.466
0.250
-0.736
-1.597
-0.985
C(21)-C(26)
-0.048
-1.466
0.250
0.206
-2.613
1.047
C(22)-C(23)
-0.736
-1.597
-0.985
-1.170
-2.876
-1.424
C(22)-H(34)
-0.736
-1.597
-0.985
-0.924
-0.710
-1.607
C(23)-C(24)
-1.170
-2.876
-1.424
-0.916
-4.024
-0.627
C(23)-H(33)
-1.170
-2.876
-1.424
-1.694
-2.979
-2.385
C(24)-C(25)
-0.916
-4.024
-0.627
-0.228
-3.892
0.609
C(24)-H(31)
-0.916
-4.024
-0.627
-1.244
-5.016
-0.971
C(25)-C(26)
-0.228
-3.892
0.609
0.206
-2.613
1.047
C(25)-H(32)
-0.228
-3.892
0.609
-0.024
-4.783
1.222
C(26)-C(27)
0.206
-2.613
1.047
0.937
-2.239
2.322
C(27)-O(28)
0.937
-2.239
2.322
1.438
-2.662
3.337
C(27)-O(29)
0.937
-2.239
2.322
1.030
-0.681
2.115
