ATOM 18
1 C8y C 19.4210 -17.9429
2 C7a C 20.6303 -18.6322
3 C8x C 19.4210 -16.5350
4 C8x C 18.2117 -18.6380
5 O7a O 21.8454 -17.9369
6 O6a O 20.6244 -20.0401
7 C8x C 18.2117 -15.8340
8 C8x C 16.9967 -17.9429
9 C1b C 23.0606 -18.6263
10 C8y C 16.9967 -16.5350
11 C1b C 24.2757 -17.9254
12 N1a N 15.7757 -15.8397
13 N1c N 25.4909 -18.6205
14 C1b C 26.6942 -17.9195
15 C1b C 25.4909 -20.0167
16 C1a C 27.9093 -18.6146
17 C1a C 26.6942 -20.7237
18 X Cl 30.4040 -20.5309
BOND 17
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 4 8 1
8 5 9 1
9 7 10 1
10 9 11 1
11 10 12 1
12 11 13 1
13 13 14 1
14 13 15 1
15 14 16 1
16 15 17 1
17 8 10 2
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