0 mol 44 unq 0 iso 0 dist 8.28079 7.74211 6.11574 13.7522 9.9674 9.1276 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 9.28357 7.17313 5.37449 8.18572 5.34337 8.8326 numMergedOcc 0
2 mol 81 unq 0 iso 0 dist 8.53662 13.4131 9.24998 17.3413 9.94655 7.81965 numMergedOcc 0
3 mol 81 unq 1 iso 0 dist 8.16146 7.717 9.24998 12.7235 9.94655 7.81965 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 8.96628 5.85333 8.09751 8.29463 6.55074 5.30117 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 6.25968 5.58691 6.00896 10.2034 7.45747 6.41759 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 6.17381 7.37385 4.62366 9.64566 4.65363 6.91511 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 9.39996 5.51888 8.3622 11.7422 10.5172 8.14405 numMergedOcc 0
8 mol 171 unq 0 iso 0 dist 9.23587 5.07414 4.59484 12.8263 5.35456 8.09699 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 9.77271 4.50907 8.49577 13.2529 13.4486 9.07247 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 9.19442 4.30527 8.92121 6.58055 11.1207 8.03092 numMergedOcc 0
11 mol 239 unq 1 iso 0 dist 6.77267 11.0259 7.10828 10.0981 7.26668 6.0567 numMergedOcc 0
12 mol 279 unq 0 iso 0 dist 7.81641 6.68699 8.52827 15.699 13.4439 9.44618 numMergedOcc 0
13 mol 283 unq 0 iso 0 dist 8.57375 5.72409 6.93798 8.106 5.55396 8.39635 numMergedOcc 0
