ATOM 29
1 C1z C 20.3624 -19.0569
2 C1z C 19.1720 -19.7395
3 C1y C 21.5467 -19.7512
4 C1x C 19.1605 -18.3627
5 C1x C 20.3741 -17.6859
6 C1y C 19.1664 -21.1105
7 C1x C 17.9820 -19.0569
8 C1z C 22.7311 -19.0745
9 C1x C 21.5467 -21.1222
10 C1x C 21.5701 -17.0091
11 C1x C 20.3508 -21.8107
12 C1x C 17.9820 -21.8049
13 C1x C 16.7918 -19.7395
14 C1z C 22.7484 -17.7092
15 C1x C 25.0998 -19.0334
16 C1a C 22.7194 -20.4454
17 C1y C 16.7918 -21.1105
18 C1y C 23.9446 -17.0383
19 C1a C 22.7428 -16.3324
20 C1x C 25.1173 -17.7383
21 O1a O 15.6017 -21.8049
22 C1c C 23.9388 -15.6614
23 C1b C 25.1173 -14.9788
24 C1a C 22.7428 -14.9845
25 C1b C 26.3075 -15.6556
26 C1b C 27.4919 -14.9729
27 C1c C 28.6762 -15.6497
28 C1a C 28.6762 -17.0148
29 C1a C 29.8722 -14.9612
BOND 33
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 5 10 1
10 6 11 1
11 6 12 1
12 7 13 1
13 8 14 1
14 8 15 1
15 8 16 1 #Down
16 12 17 1
17 14 18 1
18 14 19 1 #Up
19 15 20 1
20 17 21 1 #Up
21 18 22 1
22 22 23 1
23 22 24 1 #Down
24 23 25 1
25 25 26 1
26 26 27 1
27 27 28 1
28 27 29 1
29 2 4 1 #Up
30 9 11 1
31 10 14 1
32 13 17 1
33 18 20 1
|