ATOM 9
1 S4a S 20.5080 -15.5918
2 C1b C 19.2438 -14.8895
3 O1d O 21.7020 -14.9597
4 C1c C 17.9796 -15.5216
5 C1b C 16.7858 -14.8895
6 N1a N 17.9796 -16.9965
7 O1a O 15.5918 -15.5216
8 O1d O 19.7355 -16.7858
9 O1d O 21.4913 -16.5751
BOND 8
1 1 2 1
2 1 3 1
3 2 4 1
4 4 5 1
5 4 6 1 #Up
6 5 7 1
7 1 8 2
8 1 9 2
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