ATOM 28
1 C8x C 20.1313 -18.2143
2 C8x C 20.5586 -19.5567
3 N5x N 21.9348 -19.8579
4 C8y C 22.8838 -18.8166
5 C8y C 22.4565 -17.4742
6 C8x C 21.0803 -17.1730
7 C8y C 24.2926 -18.8252
8 C8y C 24.7360 -17.4879
9 C1z C 23.6013 -16.6530
10 N5x N 25.2288 -19.8777
11 C8x C 26.6087 -19.5932
12 C8x C 27.0520 -18.2559
13 C8x C 26.1157 -17.2033
14 C1b C 24.5974 -15.6569
15 C1b C 22.6050 -15.6569
16 C8y C 21.2516 -15.6672
17 C8y C 25.9346 -15.6625
18 C8x C 20.5416 -14.4919
19 C8x C 19.1331 -14.5199
20 N5x N 18.4531 -15.7536
21 C8x C 19.1630 -16.9289
22 C8x C 20.5715 -16.9709
23 C8x C 26.6151 -16.8527
24 C8x C 28.0239 -16.8587
25 N5x N 28.7333 -15.6416
26 C8x C 28.0528 -14.4513
27 C8x C 26.6440 -14.4454
28 O0 O 31.0100 -19.1800
BOND 31
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 5 9 1
11 7 10 2
12 10 11 1
13 11 12 2
14 12 13 1
15 8 13 2
16 9 14 1
17 9 15 1
18 15 16 1
19 14 17 1
20 16 18 2
21 18 19 1
22 19 20 2
23 20 21 1
24 21 22 2
25 16 22 1
26 17 23 2
27 23 24 1
28 24 25 2
29 25 26 1
30 26 27 2
31 17 27 1
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