2107
Edit1
23
23
0.250980406999588
0
0
C(1)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-1.326
-1.095
0.454
N(2)
1.39199995994568
0.34799998998642
0.200000002980232
0.200000002980232
0.800000011920929
-0.208
-1.827
0.211
C(3)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
0.839
-1.124
-0.294
C(4)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
0.793
0.271
-0.557
C(5)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.178
0.926
-0.350
C(6)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-1.337
0.298
0.179
O(7)
1.33299994468689
0.333249986171722
0.800000011920929
0.200000002980232
0.200000002980232
-2.448
1.030
0.433
C(9)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-2.284
-1.705
1.429
C(13)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
2.006
0.938
-1.126
O(16)
1.33299994468689
0.333249986171722
0.800000011920929
0.200000002980232
0.200000002980232
3.037
-0.024
-1.304
C(18)
1.46200001239777
0.365500003099442
0.310000002384186
0.180000007152557
0.0350000001490116
-0.183
2.392
-0.655
O(21)
1.33299994468689
0.333249986171722
0.800000011920929
0.200000002980232
0.200000002980232
-0.437
3.124
0.536
H(23)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
1.769
-1.666
-0.520
H(8)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-2.746
1.424
-0.404
H(10)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-1.891
-2.682
1.789
H(11)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-3.271
-1.870
0.940
H(12)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-2.424
-1.028
2.301
H(14)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
2.390
1.687
-0.401
H(15)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
1.767
1.340
-2.134
H(17)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
3.223
-0.386
-0.455
H(19)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-1.016
2.621
-1.354
H(20)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
0.824
2.698
-1.010
H(22)
0.777999997138977
0.194499999284744
0.300000011920929
0.800000011920929
0.800000011920929
-1.279
2.846
0.854
C(1)-N(2)
-1.326
-1.095
0.454
-0.208
-1.827
0.211
C(1)-C(6)
-1.326
-1.095
0.454
-1.337
0.298
0.179
C(1)-C(9)
-1.326
-1.095
0.454
-2.284
-1.705
1.429
N(2)-C(3)
-0.208
-1.827
0.211
0.839
-1.124
-0.294
C(3)-C(4)
0.839
-1.124
-0.294
0.793
0.271
-0.557
C(3)-H(23)
0.839
-1.124
-0.294
1.769
-1.666
-0.520
C(4)-C(5)
0.793
0.271
-0.557
-0.178
0.926
-0.350
C(4)-C(13)
0.793
0.271
-0.557
2.006
0.938
-1.126
C(5)-C(6)
-0.178
0.926
-0.350
-1.337
0.298
0.179
C(5)-C(18)
-0.178
0.926
-0.350
-0.183
2.392
-0.655
C(6)-O(7)
-1.337
0.298
0.179
-2.448
1.030
0.433
O(7)-H(8)
-2.448
1.030
0.433
-2.746
1.424
-0.404
C(9)-H(10)
-2.284
-1.705
1.429
-1.891
-2.682
1.789
C(9)-H(11)
-2.284
-1.705
1.429
-3.271
-1.870
0.940
C(9)-H(12)
-2.284
-1.705
1.429
-2.424
-1.028
2.301
C(13)-O(16)
2.006
0.938
-1.126
3.037
-0.024
-1.304
C(13)-H(14)
2.006
0.938
-1.126
2.390
1.687
-0.401
C(13)-H(15)
2.006
0.938
-1.126
1.767
1.340
-2.134
O(16)-H(17)
3.037
-0.024
-1.304
3.223
-0.386
-0.455
C(18)-O(21)
-0.183
2.392
-0.655
-0.437
3.124
0.536
C(18)-H(19)
-0.183
2.392
-0.655
-1.016
2.621
-1.354
C(18)-H(20)
-0.183
2.392
-0.655
0.824
2.698
-1.010
O(21)-H(22)
-0.437
3.124
0.536
-1.279
2.846
0.854
