0 mol 6 unq 0 iso 0 dist 7.6948 7.74208 6.6223 6.67429 8.31647 10.3831 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 5.25583 7.86307 7.03296 5.77108 6.6051 10.5896 numMergedOcc 0
2 mol 12 unq 1 iso 0 dist 5.25583 7.86307 7.03296 8.27891 8.15864 14.2209 numMergedOcc 0
3 mol 134 unq 0 iso 0 dist 6.25968 6.77398 11.0076 10.9848 9.88178 15.8314 numMergedOcc 0
4 mol 134 unq 1 iso 0 dist 6.25968 5.68207 5.54305 10.9848 9.88178 14.2222 numMergedOcc 0
5 mol 140 unq 0 iso 0 dist 9.16949 7.59889 10.9472 11.7651 9.13339 10.5239 numMergedOcc 0
6 mol 140 unq 1 iso 0 dist 9.16949 7.59889 10.9472 5.14081 7.60956 10.1762 numMergedOcc 0
7 mol 140 unq 2 iso 0 dist 8.65294 7.59889 8.08387 5.14081 9.9171 10.1762 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 9.89646 7.9061 15.5988 12.352 5.32865 18.7028 numMergedOcc 0
9 mol 147 unq 1 iso 0 dist 9.89646 4.48898 10.9183 12.352 5.32865 14.8347 numMergedOcc 0
10 mol 157 unq 0 iso 0 dist 6.97303 7.36432 4.86515 6.72897 6.8976 10.6027 numMergedOcc 0
11 mol 174 unq 0 iso 0 dist 8.36618 8.79469 5.2323 9.60153 8.16228 12.739 numMergedOcc 0
12 mol 187 unq 0 iso 0 dist 9.383 6.98159 6.47437 6.06679 5.58167 6.56642 numMergedOcc 0
13 mol 255 unq 0 iso 0 dist 5.53395 7.60846 4.88615 5.96376 9.40767 12.6693 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 6.77021 8.20751 11.8838 9.76099 7.53199 15.068 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 6.77021 8.20751 11.8838 5.83092 8.58092 6.73928 numMergedOcc 0
16 mol 258 unq 2 iso 0 dist 6.77021 8.20751 11.8838 5.09024 7.40014 11.3749 numMergedOcc 0
17 mol 280 unq 0 iso 0 dist 9.79817 7.10608 13.5709 9.73214 8.83076 16.1208 numMergedOcc 0
18 mol 280 unq 1 iso 0 dist 9.79817 7.10608 13.5709 13.8226 9.76967 19.2455 numMergedOcc 0
19 mol 280 unq 2 iso 0 dist 9.79817 7.22993 8.62293 9.73214 8.83076 11.7068 numMergedOcc 0
20 mol 280 unq 3 iso 0 dist 9.79817 7.22993 8.62293 13.8226 9.76967 17.0001 numMergedOcc 0
