0 mol 16 unq 0 iso 0 dist 6.75381 5.48497 8.47315 10.3873 6.72833 12.1062 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 6.47132 10.6275 6.48625 5.09938 8.08618 9.97686 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 9.58693 15.6711 9.59261 10.8137 5.78706 5.24592 numMergedOcc 0
3 mol 102 unq 0 iso 0 dist 5.79411 6.82817 9.01767 4.26679 8.31932 10.4216 numMergedOcc 0
4 mol 102 unq 1 iso 0 dist 5.79411 10.6581 9.80678 4.26679 8.31932 12.8733 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 6.3982 5.93926 6.7225 10.6104 6.92026 6.39438 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 6.44766 9.91056 8.97145 12.0238 8.70296 4.17212 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 6.44766 9.91056 8.97145 6.81696 9.25558 13.6005 numMergedOcc 0
8 mol 131 unq 2 iso 0 dist 6.44766 4.56884 6.5874 12.0238 8.70296 9.64263 numMergedOcc 0
9 mol 131 unq 3 iso 0 dist 6.44766 4.56884 6.5874 6.81696 9.25558 5.55307 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.31743 8.14784 7.78849 6.89623 5.83771 4.15314 numMergedOcc 0
11 mol 135 unq 0 iso 0 dist 9.13451 6.97453 6.5228 4.14325 5.62052 5.14857 numMergedOcc 0
12 mol 135 unq 1 iso 0 dist 9.13451 6.97453 6.5228 5.67656 7.90563 5.26692 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 9.84636 16.2248 9.03194 6.84084 7.33273 11.2154 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 9.00273 17.3985 8.64255 15.996 7.50013 4.91904 numMergedOcc 0
15 mol 197 unq 1 iso 0 dist 9.00273 17.3985 8.64255 13.9428 5.81233 7.59634 numMergedOcc 0
16 mol 197 unq 2 iso 0 dist 9.00273 17.3985 8.64255 10.6805 6.92924 10.3181 numMergedOcc 0
17 mol 197 unq 3 iso 0 dist 9.00273 17.3985 8.64255 8.06716 7.14306 14.2718 numMergedOcc 0
18 mol 197 unq 4 iso 0 dist 7.19387 14.5201 8.64255 11.8776 7.50013 4.91904 numMergedOcc 0
19 mol 197 unq 5 iso 0 dist 7.19387 14.5201 8.64255 7.82456 5.81233 7.59634 numMergedOcc 0
20 mol 197 unq 6 iso 0 dist 7.19387 14.5201 8.64255 12.657 6.92924 10.3181 numMergedOcc 0
21 mol 197 unq 7 iso 0 dist 7.19387 14.5201 8.64255 6.07107 7.14306 14.2718 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 9.73858 11.2409 6.37342 4.91532 8.84636 7.48655 numMergedOcc 0
23 mol 249 unq 0 iso 0 dist 9.14351 10.0482 7.29898 5.56847 5.48118 10.4369 numMergedOcc 0
24 mol 249 unq 1 iso 0 dist 9.14351 14.5045 8.91685 5.56847 5.48118 13.4788 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 9.89728 16.8866 7.93997 13.5186 7.08526 10.9643 numMergedOcc 0
26 mol 278 unq 0 iso 0 dist 8.62414 18.1946 9.82774 10.5063 8.00673 11.9007 numMergedOcc 0
