ATOM 28
1 O7a O 30.0452 -20.9072
2 C7a C 31.1381 -20.2324
3 C1c C 32.3436 -20.9283
4 C1a C 33.5491 -20.2324
5 C1a C 32.3436 -22.3203
6 O6a O 31.1381 -18.8404
7 C1z C 28.6772 -17.5467
8 C1y C 27.4523 -16.8731
9 O2x O 28.7139 -16.1456
10 C1x C 29.0507 -18.8946
11 C1a C 29.8719 -16.8242
12 C1x C 26.0502 -16.8932
13 C1y C 28.7099 -20.2469
14 C1y C 24.8413 -17.6037
15 C1y C 27.4931 -21.0253
16 C2y C 24.5135 -18.9212
17 O7a O 23.7269 -16.7631
18 C1y C 26.1061 -20.9665
19 C2y C 27.9277 -22.2805
20 C2x C 24.8852 -20.2771
21 C1a C 23.1138 -18.9334
22 C7a C 23.7069 -15.3612
23 O7x O 25.6745 -22.2914
24 C7x C 26.8051 -23.1021
25 C2a C 29.2626 -22.7061
26 C1a C 22.4939 -14.6739
27 O6a O 24.9127 -14.6457
28 O6a O 26.8121 -24.5050
BOND 30
1 3 4 1
2 3 5 1
3 2 3 1
4 2 6 2
5 1 2 1
6 7 8 1
7 7 9 1
8 7 10 1
9 7 11 1 #Up
10 8 12 1
11 10 13 1
12 12 14 1
13 13 15 1
14 13 1 1 #Up
15 14 16 1
16 14 17 1 #Up
17 15 18 1
18 15 19 1
19 16 20 2
20 16 21 1
21 17 22 1
22 18 23 1
23 19 24 1
24 19 25 2
25 22 26 1
26 22 27 2
27 24 28 2
28 8 9 1
29 18 20 1
30 23 24 1
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