ATOM 19
1 C1z C 24.5154 -14.9426
2 C1y C 25.3727 -16.0471
3 C1z C 24.8399 -13.5832
4 C5x C 23.1253 -15.0577
5 C1a C 23.5313 -16.2845
6 C1y C 26.7815 -16.0637
7 O7x O 24.9298 -17.3788
8 C2x C 23.6448 -12.8559
9 C1y C 26.1090 -12.9887
10 O1a O 24.8325 -12.1809
11 C2x C 22.5894 -13.7682
12 O5x O 22.3958 -16.2447
13 C1y C 27.1994 -17.4063
14 C1x C 27.6646 -14.9716
15 C7x C 26.0531 -18.2194
16 C1x C 27.3709 -13.5998
17 C1a C 26.1200 -11.5901
18 C1a C 28.5231 -17.8515
19 O6a O 26.0372 -19.6151
BOND 21
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 3 10 1 #Down
10 4 11 1
11 4 12 2
12 6 13 1
13 6 14 1
14 7 15 1
15 9 16 1
16 9 17 1 #Up
17 13 18 1 #Up
18 15 19 2
19 8 11 2
20 13 15 1
21 14 16 1
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