ATOM 19
1 C1x C 19.5447 -19.5571
2 C1x C 19.5447 -20.9603
3 C1x C 20.7628 -21.6618
4 C1x C 21.9738 -20.9603
5 C1y C 21.9738 -19.5571
6 C1x C 20.7628 -18.8555
7 C1b C 23.1802 -18.8627
8 C1b C 24.3920 -19.5642
9 C1b C 25.6038 -18.8696
10 C1b C 26.8157 -19.5712
11 C1b C 28.0275 -18.8768
12 C1b C 29.2393 -19.5784
13 C1b C 30.4511 -18.8839
14 C1b C 31.6630 -19.5855
15 C1b C 32.8748 -18.8909
16 C1b C 34.0866 -19.5925
17 C6a C 35.2984 -18.8980
18 O6a O 36.5113 -19.6035
19 O6a O 35.3028 -17.4949
BOND 19
1 3 4 1
2 9 10 1
3 4 5 1
4 10 11 1
5 5 6 1
6 11 12 1
7 6 1 1
8 12 13 1
9 13 14 1
10 5 7 1
11 14 15 1
12 1 2 1
13 15 16 1
14 7 8 1
15 16 17 1
16 2 3 1
17 17 18 1
18 8 9 1
19 17 19 2
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