ATOM 33
1 C1z C 17.8531 -14.5207
2 C1y C 19.0714 -15.2260
3 C1x C 18.5467 -13.3024
4 O2x O 17.1419 -13.3200
5 C1x C 16.6465 -15.2260
6 C1z C 20.2722 -14.5207
7 C1y C 19.0714 -16.6309
8 C1x C 16.6465 -16.6309
9 C1y C 21.4847 -15.2202
10 O2x O 21.4731 -13.8212
11 C1a C 20.2664 -13.1217
12 C1y C 17.8590 -17.3245
13 O2a O 20.2838 -17.3245
14 C1b C 22.6972 -14.5150
15 O7a O 17.8590 -18.7295
16 C1a C 21.4964 -16.6134
17 C2b C 23.9097 -15.2143
18 C7a C 19.0714 -19.4173
19 C2c C 25.1221 -14.5091
20 C2b C 20.2838 -18.7119
21 O6a O 19.0772 -20.8221
22 C1a C 26.3345 -15.2086
23 C1a C 25.1164 -13.1043
24 C2b C 21.4964 -19.4114
25 C2b C 22.7031 -18.7062
26 C2b C 23.9155 -19.4057
27 C2b C 25.1279 -18.7002
28 C2b C 26.3405 -19.3998
29 C2b C 27.5412 -18.6945
30 C2b C 28.7538 -19.3881
31 C6a C 29.9662 -18.6828
32 O6a O 31.1788 -19.3824
33 O6a O 29.9662 -17.2838
BOND 35
1 1 2 1
2 1 3 1 #Down
3 1 4 1 #Up
4 1 5 1
5 2 6 1
6 2 7 1
7 5 8 1
8 6 9 1
9 6 10 1 #Up
10 6 11 1 #Down
11 7 12 1
12 7 13 1 #Down
13 9 14 1 #Down
14 12 15 1 #Down
15 13 16 1
16 14 17 1
17 15 18 1
18 17 19 2
19 18 20 1
20 18 21 2
21 19 22 1
22 19 23 1
23 20 24 2
24 24 25 1
25 25 26 2
26 26 27 1
27 27 28 2
28 28 29 1
29 29 30 2
30 30 31 1
31 31 32 1
32 31 33 2
33 3 4 1
34 8 12 1
35 9 10 1 #Up
| 
