ATOM 26
1 C8y C 20.3587 -15.5585
2 C1y C 19.3360 -14.5885
3 C8y C 20.3412 -17.0009
4 C8x C 21.4796 -14.8923
5 N1y N 17.7727 -15.7164
6 C1x C 17.9754 -14.5710
7 C1x C 19.3723 -17.8005
8 C8x C 21.4445 -17.6193
9 C8y C 22.5830 -15.5808
10 C1y C 17.9286 -17.8530
11 C1a C 18.9133 -16.1579
12 C8y C 17.0124 -15.5237
13 C8y C 22.6355 -16.9541
14 O2a O 23.8149 -14.9100
15 C8y C 16.9890 -16.8842
16 C8x C 15.8389 -14.8106
17 O2a O 23.7973 -17.6310
18 C1a C 24.9825 -15.5808
19 C8x C 15.7864 -17.5435
20 C8y C 14.6421 -15.4769
21 C1a C 24.9708 -16.9424
22 C8y C 14.6127 -16.8431
23 O2a O 13.4452 -14.8632
24 O2a O 13.4862 -17.5900
25 C1a C 12.2601 -15.5411
26 C1a C 12.3186 -16.9190
BOND 29
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 10 5 1
10 5 11 1
11 6 12 1
12 8 13 2
13 9 14 1
14 10 15 1
15 12 16 1
16 13 17 1
17 14 18 1
18 15 19 1
19 16 20 2
20 17 21 1
21 19 22 2
22 20 23 1
23 22 24 1
24 23 25 1
25 24 26 1
26 7 10 1
27 9 13 1
28 12 15 2
29 20 22 1
|