0 mol 5 unq 0 iso 0 dist 9.89833 3.99762 9.65106 10.0107 7.89848 6.81899 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.15734 5.2522 9.19117 8.4435 5.7208 6.81899 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 7.15734 5.13643 8.59504 8.4435 5.7208 9.22198 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 7.15734 10.0436 7.75279 8.4435 5.7208 7.89217 numMergedOcc 0
4 mol 5 unq 4 iso 0 dist 7.15734 10.0436 7.75279 11.5084 4.8206 6.99733 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 8.25984 4.22382 5.51659 11.6914 6.82158 7.67459 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 9.35633 17.3887 9.80586 10.4739 6.14241 7.88143 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 9.57285 4.57152 6.89622 13.681 7.18925 9.27341 numMergedOcc 0
8 mol 152 unq 1 iso 0 dist 6.4737 10.8322 6.21275 15.7377 11.4031 9.54774 numMergedOcc 0
9 mol 209 unq 0 iso 0 dist 8.12883 10.2809 8.21628 11.6851 5.18002 6.82209 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 7.86207 8.20682 7.81237 11.9831 11.6555 9.57625 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 7.21466 6.18958 8.39251 10.5624 6.88711 7.80073 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 9.99337 11.0006 8.86734 11.8311 4.36577 8.00841 numMergedOcc 0
13 mol 244 unq 0 iso 0 dist 6.51428 5.65728 5.97452 10.0349 4.71142 7.36972 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 9.07452 9.62798 7.32898 15.9741 9.94976 8.76302 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 9.07452 9.62798 7.32898 6.08059 5.44831 9.11322 numMergedOcc 0
16 mol 274 unq 2 iso 0 dist 6.12202 6.75848 9.70022 10.9592 12.119 8.76302 numMergedOcc 0
17 mol 274 unq 3 iso 0 dist 6.12202 6.75848 9.70022 15.8126 17.2375 9.11322 numMergedOcc 0
18 mol 274 unq 4 iso 0 dist 6.44266 8.2168 7.32898 14.161 9.94976 8.76302 numMergedOcc 0
19 mol 274 unq 5 iso 0 dist 6.44266 8.2168 7.32898 10.2998 5.44831 9.11322 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 7.88405 6.82967 8.63928 9.0626 5.2842 6.53354 numMergedOcc 0
