0 mol 95 unq 0 iso 0 dist 5.99463 6.30451 9.07757 12.3656 10.1228 9.47394 numMergedOcc 0
1 mol 136 unq 0 iso 0 dist 6.6829 9.61557 9.67457 12.403 13.4598 8.99371 numMergedOcc 0
2 mol 158 unq 0 iso 0 dist 9.66949 7.43284 6.45502 15.6408 10.9769 8.6903 numMergedOcc 0
3 mol 193 unq 0 iso 0 dist 8.10951 5.18783 8.51497 5.03276 9.50163 8.30095 numMergedOcc 0
4 mol 198 unq 0 iso 0 dist 9.81188 13.3213 7.91967 19.8843 15.0552 8.73074 numMergedOcc 0
5 mol 198 unq 1 iso 0 dist 4.39804 6.10549 7.83611 10.4331 7.54337 8.73074 numMergedOcc 0
6 mol 198 unq 2 iso 0 dist 9.77781 16.0209 7.83611 14.8481 7.54337 8.73074 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 9.71975 8.26563 7.5696 12.9075 6.67496 7.30459 numMergedOcc 0
8 mol 204 unq 1 iso 0 dist 9.71975 8.26563 7.5696 5.13145 6.81615 8.73423 numMergedOcc 0
9 mol 204 unq 2 iso 0 dist 6.69026 8.66568 9.3369 8.76729 4.7869 6.97502 numMergedOcc 0
10 mol 204 unq 3 iso 0 dist 6.69026 8.66568 9.3369 17.4206 16.4963 8.8078 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 6.09318 6.96816 7.19924 11.7093 9.3643 6.17408 numMergedOcc 0
12 mol 239 unq 1 iso 0 dist 6.09318 6.96816 7.19924 10.0752 9.47569 6.17602 numMergedOcc 0
13 mol 241 unq 0 iso 0 dist 8.67228 12.286 8.89382 11.0067 5.07803 8.50897 numMergedOcc 0
14 mol 241 unq 1 iso 0 dist 8.67228 12.286 8.89382 18.0857 10.9305 8.10031 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 5.85222 5.45863 8.27377 11.7585 9.97671 8.2681 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 8.03252 12.652 9.48559 14.3089 7.47959 9.79758 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 7.94434 6.54424 4.09984 14.3674 8.15057 7.85044 numMergedOcc 0
