2107
1,3-
29
30
0.858823537826538
0.639215707778931
0.176470592617989
C(1)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-2.250
0.831
0.787
C(2)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-2.225
-0.303
-0.067
C(3)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-2.748
-0.212
-1.384
C(4)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-3.296
1.014
-1.847
C(5)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-3.320
2.148
-0.993
C(6)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-2.797
2.057
0.324
N(7)
1.39199995994568
0.34799998998642
0.200000002980232
0.200000002980232
0.800000011920929
-1.700
0.740
2.139
C(9)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.596
1.563
2.629
N(10)
1.39199995994568
0.34799998998642
0.200000002980232
0.200000002980232
0.800000011920929
0.668
1.437
1.905
C(12)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
1.413
0.187
1.772
C(13)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
2.739
0.093
2.272
C(14)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
3.458
-1.126
2.153
C(15)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
2.851
-2.251
1.535
C(16)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
1.526
-2.157
1.035
C(17)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
0.806
-0.939
1.154
N(18)
1.39199995994568
0.34799998998642
0.200000002980232
0.200000002980232
0.800000011920929
-0.722
2.326
3.624
H(29)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-1.810
-1.255
0.295
H(27)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-2.738
-1.093
-2.042
H(26)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-3.709
1.083
-2.864
H(25)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-3.752
3.095
-1.348
H(28)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-2.824
2.933
0.989
H(8)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-2.118
0.035
2.795
H(11)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
1.069
2.300
1.461
H(24)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
3.205
0.962
2.759
H(22)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
4.482
-1.201
2.549
H(21)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
3.405
-3.198
1.451
H(20)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
1.052
-3.032
0.565
H(23)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-0.224
-0.869
0.775
H(19)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
0.158
2.812
3.806
C(1)-C(2)
-2.250
0.831
0.787
-2.225
-0.303
-0.067
C(1)-C(6)
-2.250
0.831
0.787
-2.797
2.057
0.324
C(1)-N(7)
-2.250
0.831
0.787
-1.700
0.740
2.139
C(2)-C(3)
-2.225
-0.303
-0.067
-2.748
-0.212
-1.384
C(2)-H(29)
-2.225
-0.303
-0.067
-1.810
-1.255
0.295
C(3)-C(4)
-2.748
-0.212
-1.384
-3.296
1.014
-1.847
C(3)-H(27)
-2.748
-0.212
-1.384
-2.738
-1.093
-2.042
C(4)-C(5)
-3.296
1.014
-1.847
-3.320
2.148
-0.993
C(4)-H(26)
-3.296
1.014
-1.847
-3.709
1.083
-2.864
C(5)-C(6)
-3.320
2.148
-0.993
-2.797
2.057
0.324
C(5)-H(25)
-3.320
2.148
-0.993
-3.752
3.095
-1.348
C(6)-H(28)
-2.797
2.057
0.324
-2.824
2.933
0.989
N(7)-C(9)
-1.700
0.740
2.139
-0.596
1.563
2.629
N(7)-H(8)
-1.700
0.740
2.139
-2.118
0.035
2.795
C(9)-N(10)
-0.596
1.563
2.629
0.668
1.437
1.905
C(9)-N(18)
-0.596
1.563
2.629
-0.722
2.326
3.624
N(10)-C(12)
0.668
1.437
1.905
1.413
0.187
1.772
N(10)-H(11)
0.668
1.437
1.905
1.069
2.300
1.461
C(12)-C(13)
1.413
0.187
1.772
2.739
0.093
2.272
C(12)-C(17)
1.413
0.187
1.772
0.806
-0.939
1.154
C(13)-C(14)
2.739
0.093
2.272
3.458
-1.126
2.153
C(13)-H(24)
2.739
0.093
2.272
3.205
0.962
2.759
C(14)-C(15)
3.458
-1.126
2.153
2.851
-2.251
1.535
C(14)-H(22)
3.458
-1.126
2.153
4.482
-1.201
2.549
C(15)-C(16)
2.851
-2.251
1.535
1.526
-2.157
1.035
C(15)-H(21)
2.851
-2.251
1.535
3.405
-3.198
1.451
C(16)-C(17)
1.526
-2.157
1.035
0.806
-0.939
1.154
C(16)-H(20)
1.526
-2.157
1.035
1.052
-3.032
0.565
C(17)-H(23)
0.806
-0.939
1.154
-0.224
-0.869
0.775
N(18)-H(19)
-0.722
2.326
3.624
0.158
2.812
3.806
