ATOM 28
1 C1z C 24.9585 -17.1429
2 C1x C 24.2588 -15.9302
3 C1x C 23.5592 -17.1429
4 C8y C 30.6955 -16.9097
5 N4y N 31.9549 -17.6094
6 C8y C 29.5294 -17.6094
7 C8y C 30.6955 -15.5104
8 C1y C 31.9549 -19.0087
9 C8x C 33.1209 -16.9097
10 C8y C 28.3167 -16.9097
11 X Cl 29.5294 -19.0087
12 C8y C 31.9082 -14.8108
13 C8x C 29.5294 -14.8108
14 C1y C 32.6545 -20.2213
15 C1x C 31.2553 -20.2213
16 C8y C 33.1209 -15.5104
17 N1y N 27.1040 -17.7959
18 C8y C 28.3167 -15.5104
19 O5x O 31.9082 -13.4114
20 C6a C 34.3337 -14.8108
21 C1x C 26.2644 -16.6765
22 C1x C 26.3111 -18.9620
23 X F 27.1040 -14.8108
24 O6a O 35.5464 -15.5104
25 O6a O 34.3337 -13.4114
26 C1y C 24.9585 -18.5422
27 X F 33.8672 -20.9210
28 N1a N 23.8390 -19.3351
BOND 32
1 1 2 1
2 1 3 1
3 4 5 1
4 4 6 1
5 4 7 2
6 5 8 1 #Up
7 5 9 1
8 6 10 2
9 6 11 1
10 7 12 1
11 7 13 1
12 8 14 1
13 8 15 1
14 9 16 2
15 10 17 1
16 10 18 1
17 12 19 2
18 16 20 1
19 17 21 1
20 17 22 1
21 18 23 1
22 20 24 1
23 20 25 2
24 21 1 1
25 22 26 1
26 12 16 1
27 13 18 2
28 14 15 1
29 1 26 1
30 3 2 1
31 14 27 1 #Up
32 26 28 1 #Up
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