ATOM 27
1 C8y C 25.5024 -16.3520
2 C1y C 26.7164 -17.0581
3 C8y C 25.5083 -14.9513
4 C8y C 24.2943 -17.0524
5 N1y N 27.9302 -16.3578
6 C1x C 26.7164 -18.4588
7 C8x C 24.2943 -14.2451
8 C1x C 26.7281 -14.2510
9 C8y C 23.0747 -16.3520
10 O1a O 24.2826 -18.4530
11 C1x C 29.1442 -17.0581
12 C1x C 27.9361 -14.9571
13 C8y C 27.9361 -19.1534
14 C8y C 23.0747 -14.9454
15 O2a O 21.8666 -17.0524
16 C8y C 29.1442 -18.4588
17 C8x C 27.9302 -20.5481
18 O2a O 21.8607 -14.2393
19 C1a C 20.6585 -16.3520
20 C8y C 30.3523 -19.1651
21 C8x C 29.1383 -21.2485
22 C1a C 20.6469 -14.9337
23 C8y C 30.3464 -20.5598
24 O2a O 31.5485 -18.4530
25 O2a O 31.5485 -21.2542
26 C1a C 32.7625 -19.1534
27 C1a C 32.7625 -20.5539
BOND 30
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 7 14 1
14 9 15 1
15 11 16 1
16 13 17 1
17 14 18 1
18 15 19 1
19 16 20 1
20 17 21 2
21 18 22 1
22 20 23 2
23 20 24 1
24 23 25 1
25 24 26 1
26 25 27 1
27 8 12 1
28 9 14 2
29 13 16 2
30 21 23 1
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