ATOM 32
1 C1y C 7.6418 -9.2247
2 O2x O 6.4302 -8.5140
3 C1x C 7.6361 -10.6228
4 C8y C 5.2127 -9.2131
5 O2x O 6.4186 -11.3161
6 C8y C 5.2070 -10.6170
7 C8x C 4.0069 -8.5083
8 C8x C 4.0069 -11.3102
9 C8x C 2.7894 -9.2131
10 C8x C 2.7894 -10.6170
11 N1y N 11.2826 -8.5316
12 C1b C 10.0710 -9.2364
13 C1b C 8.8593 -8.5257
14 C1x C 12.4914 -9.2243
15 C1x C 13.7016 -8.5204
16 C1y C 13.6971 -7.1204
17 C1x C 12.4883 -6.4277
18 C1x C 11.2781 -7.1316
19 N1y N 14.9155 -6.4115
20 C1x C 16.2021 -6.9790
21 C1x C 17.1394 -5.9307
22 N1x N 16.4321 -4.7154
23 C5x C 15.0577 -5.0125
24 O5x O 14.0235 -4.0880
25 C2b C 21.8963 -10.2453
26 C2b C 23.0831 -9.5472
27 C6a C 20.7095 -9.6170
28 C6a C 24.3396 -10.2453
29 O6a O 19.4530 -10.3151
30 O6a O 20.7095 -8.1510
31 O6a O 25.5264 -9.5472
32 O6a O 24.3396 -11.6415
BOND 34
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 1
6 4 7 2
7 6 8 2
8 7 9 1
9 8 10 1
10 5 6 1
11 9 10 2
12 12 13 1
13 11 12 1
14 1 13 1 #Up
15 11 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 11 18 1
21 16 19 1
22 19 20 1
23 20 21 1
24 21 22 1
25 22 23 1
26 19 23 1
27 23 24 2
28 25 26 2
29 25 27 1
30 26 28 1
31 27 29 1
32 27 30 2
33 28 31 1
34 28 32 2
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