ATOM 39
1 C1y C 22.0678 -20.3506
2 C1y C 22.0216 -21.7298
3 O2x O 20.8896 -19.6173
4 C1y C 20.8022 -22.3786
5 O1a O 23.1930 -22.4518
6 C1y C 19.6053 -20.2695
7 C1y C 19.6340 -21.6516
8 O1a O 20.7560 -23.7580
9 C1a C 18.5020 -19.5392
10 O1a O 18.4147 -22.3007
11 C1z C 29.3939 -17.9383
12 C1z C 30.5891 -17.2561
13 C1y C 28.2103 -17.2386
14 C1y C 29.3939 -19.3143
15 O2x O 30.5774 -18.6204
16 C1z C 30.6008 -15.8800
17 C1x C 32.9679 -17.2853
18 O1a O 31.6854 -18.4396
19 C1z C 27.0091 -17.9266
20 C1x C 28.2219 -15.8626
21 C1x C 28.1986 -20.0023
22 C1y C 31.8075 -15.2096
23 C1y C 29.4172 -15.1863
24 C1a C 30.5949 -14.5040
25 C1x C 32.9854 -15.9093
26 C1y C 27.0033 -19.3084
27 C1x C 25.8138 -17.2327
28 C1a C 26.9917 -16.5447
29 C2y C 31.8018 -13.8277
30 O1a O 29.4113 -13.7986
31 C1x C 25.8138 -19.9964
32 C1x C 24.6186 -17.9266
33 C1x C 31.3703 -12.5217
34 C2x C 33.1778 -13.8920
35 C1y C 24.6186 -19.3084
36 O7x O 32.4898 -11.7113
37 C7x C 33.5976 -12.5160
38 O2a O 23.4233 -19.9964
39 O6a O 34.9094 -12.0845
BOND 45
1 6 7 1
2 1 2 1
3 1 3 1
4 2 4 1
5 2 5 1 #Down
6 3 6 1
7 4 7 1
8 4 8 1 #Down
9 6 9 1 #Up
10 11 12 1
11 11 13 1
12 11 14 1
13 11 15 1 #Up
14 12 16 1
15 12 17 1
16 12 18 1 #Up
17 13 19 1
18 13 20 1
19 14 21 1
20 16 22 1
21 16 23 1
22 16 24 1 #Up
23 17 25 1
24 19 26 1
25 19 27 1
26 19 28 1 #Up
27 22 29 1
28 23 30 1 #Up
29 26 31 1
30 27 32 1
31 29 33 1
32 29 34 2
33 31 35 1
34 33 36 1
35 34 37 1
36 35 38 1 #Up
37 37 39 2
38 14 15 1 #Up
39 20 23 1
40 21 26 1
41 22 25 1
42 32 35 1
43 36 37 1
44 7 10 1 #Down
45 1 38 1 #Up
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