ATOM 11
1 C1b C 22.9407 -16.8746
2 N1d N 24.2912 -16.8746 #+
3 C1b C 22.2655 -15.7045
4 C1a C 25.2524 -18.4003
5 C1a C 25.1824 -15.3545
6 C1a C 26.0432 -16.8978
7 O2a O 20.9093 -15.7045
8 S4a S 19.5529 -15.7103
9 O1d O 19.5413 -14.2841
10 O1d O 18.2084 -15.7045
11 O1d O 19.5529 -17.0607 #-
BOND 10
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 7 8 1
8 8 9 2
9 8 10 2
10 8 11 1
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