ATOM 19
1 N1c N 27.2167 -14.8512
2 C2c C 28.4434 -15.5258
3 C1a C 26.0212 -15.5856
4 C1a C 27.2428 -13.4513
5 S0 S 29.6355 -14.7977
6 S1a S 28.4015 -16.9252 #-
7 Z Fe 28.1542 -19.2035 #3+
8 N1c N 32.9714 -20.5043
9 C2c C 31.7614 -21.2083
10 C1a C 32.9579 -19.1012
11 C1a C 34.1940 -21.1874
12 S0 S 31.7715 -22.6051
13 S1a S 30.5476 -20.5117 #-
14 N1c N 23.7256 -20.5114
15 C2c C 24.9447 -21.1993
16 C1a C 23.7208 -19.1081
17 C1a C 22.5120 -21.2105
18 S0 S 24.9529 -22.5962
19 S1a S 26.1493 -20.4869 #-
BOND 15
1 1 4 1
2 2 5 2
3 2 6 1
4 1 2 1
5 1 3 1
6 8 10 1
7 8 11 1
8 9 12 2
9 9 13 1
10 8 9 1
11 14 15 1
12 14 16 1
13 14 17 1
14 15 18 2
15 15 19 1
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