ATOM 38
1 C1z C 25.4339 -13.8695
2 C1y C 24.1996 -13.1441
3 C1y C 25.4222 -15.2911
4 C1y C 26.6682 -13.1675
5 C1x C 25.9077 -12.8337
6 C1z C 22.9655 -13.8520
7 C1z C 24.2113 -11.7227
8 C1y C 24.1879 -15.9988
9 O7x O 26.6508 -16.0105
10 C1y C 27.9026 -13.8871
11 C1y C 26.6799 -11.7402
12 O2x O 25.4625 -11.9038
13 C1y C 22.9595 -15.2794
14 C1y C 21.7252 -13.1383
15 C1a C 22.9538 -12.5647
16 C1y C 25.4516 -11.0207
17 O1a O 22.9070 -10.5312
18 O7a O 24.1764 -17.4262
19 C7x C 27.9608 -15.3086
20 O7a O 29.1426 -13.1852
21 C1a C 27.9260 -11.0384
22 C2y C 21.7252 -15.9988
23 C5x C 20.4909 -13.8520
24 O1a O 21.7312 -11.7110
25 O1a O 25.4456 -9.5759
26 C7a C 25.3871 -18.1339
27 O6a O 29.1192 -16.0339
28 C7a C 30.3712 -13.8988
29 C2x C 20.4909 -15.2794
30 C1a C 21.7312 -17.4262
31 O5x O 19.2509 -13.1383
32 C2c C 25.3754 -19.5379
33 O6a O 26.6039 -17.4437
34 C1a C 31.6112 -13.1909
35 O6a O 30.3652 -15.3260
36 C2b C 26.5805 -20.2456
37 C1a C 24.1530 -20.2282
38 C1a C 26.5688 -21.6438
BOND 42
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 4 11 1
11 5 12 1
12 6 13 1
13 6 14 1
14 6 15 1 #Up
15 7 16 1
16 7 17 1
17 8 18 1 #Down
18 9 19 1
19 10 20 1 #Up
20 11 21 1 #Down
21 13 22 1
22 14 23 1
23 14 24 1 #Up
24 16 25 1 #Down
25 18 26 1
26 19 27 2
27 20 28 1
28 22 29 2
29 22 30 1
30 23 31 2
31 26 32 1
32 26 33 2
33 28 34 1
34 28 35 2
35 32 36 2
36 32 37 1
37 36 38 1
38 7 12 1 #Up
39 8 13 1
40 10 19 1
41 11 16 1
42 23 29 1
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