ATOM 28
1 C2y C 25.3302 -18.3258
2 C1z C 25.3302 -19.7247
3 C1z C 26.5416 -20.4241
4 C1y C 27.7532 -19.7247
5 C1z C 27.7532 -18.3258
6 C2x C 26.5416 -17.6263
7 C5x C 29.0836 -20.1569
8 C1y C 29.9059 -19.0252
9 C1x C 29.0836 -17.8935
10 O5x O 29.5144 -21.4827
11 C1a C 24.1187 -17.6263
12 O1a O 27.2411 -21.6356
13 C1a C 25.8422 -21.6356
14 C1a C 31.2755 -19.0252
15 O2a O 27.7532 -16.5772
16 C1y C 28.9833 -15.8667
17 C1y C 30.1876 -16.5619
18 C1y C 31.3989 -15.8623
19 C1y C 31.3989 -14.4634
20 C1y C 30.1947 -13.7683
21 O2x O 28.9832 -14.4678
22 O1a O 30.1876 -17.9608
23 O1a O 32.6159 -13.7607
24 C1b C 30.1949 -12.3808
25 O1a O 32.6295 -16.5727
26 O1a O 31.4300 -11.6675
27 C1x C 24.3411 -20.7138
28 C1x C 23.9313 -19.7247
BOND 31
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 1
10 5 9 1
11 7 10 2
12 1 11 1
13 3 12 1 #Down
14 3 13 1 #Up
15 8 14 1 #Up
16 5 15 1 #Up
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 16 21 1
24 17 22 1 #Up
25 19 23 1 #Up
26 20 24 1 #Down
27 18 25 1 #Down
28 24 26 1
29 2 27 1
30 2 28 1
31 28 27 1
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