0 mol 5 unq 0 iso 0 dist 6.70655 8.54255 6.99733 5.2392 4.59167 9.13355 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 9.38983 11.2691 7.5169 16.1377 9.2687 8.40467 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 9.99467 5.28538 8.53135 12.6435 5.97852 8.58191 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 9.17447 6.3575 8.47518 5.11941 4.6365 5.87258 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 8.18251 7.35107 8.32948 7.57749 6.28248 6.03151 numMergedOcc 0
5 mol 46 unq 1 iso 0 dist 5.02642 7.35107 7.43338 7.57749 3.66253 6.03151 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 9.94756 4.58417 9.44388 10.1246 10.5328 5.62688 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 7.70808 10.2351 5.26536 10.4466 6.40382 4.79891 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 5.74058 5.76927 6.21554 5.82945 6.5713 9.58844 numMergedOcc 0
9 mol 142 unq 0 iso 0 dist 8.38255 7.18501 7.21779 10.8061 4.65943 5.90339 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 9.1056 7.47696 4.59484 12.263 5.35456 8.09699 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 8.47833 9.61557 8.27071 12.239 10.4922 7.84418 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 5.47586 7.43264 8.27071 8.69512 10.4922 7.84418 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 8.09185 9.60101 7.98724 5.03184 7.52135 8.43638 numMergedOcc 0
14 mol 212 unq 1 iso 0 dist 7.27225 14.4351 7.98724 11.3822 7.52135 8.43638 numMergedOcc 0
15 mol 212 unq 2 iso 0 dist 8.14212 11.1018 7.98724 9.54676 7.52135 8.43638 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 4.87053 6.45821 5.17916 8.86886 6.4817 7.61739 numMergedOcc 0
17 mol 222 unq 1 iso 0 dist 4.87053 6.45821 5.17916 12.4867 8.05936 9.59191 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 5.83514 5.12308 7.75366 6.96382 4.70535 5.41453 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 4.53228 4.53635 7.10828 7.96523 7.26668 6.0567 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 8.54078 9.93977 7.10828 12.4753 7.26668 6.0567 numMergedOcc 0
21 mol 247 unq 0 iso 0 dist 9.21409 8.53302 8.64941 9.01651 3.42642 5.52484 numMergedOcc 0
22 mol 247 unq 1 iso 0 dist 9.17812 9.26852 8.64941 8.83903 3.42642 5.52484 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 7.8547 14.7137 9.11322 16.6798 8.83156 9.38914 numMergedOcc 0
24 mol 276 unq 0 iso 0 dist 9.51555 6.22718 5.54217 14.123 5.97699 9.53331 numMergedOcc 0
25 mol 283 unq 0 iso 0 dist 5.90728 7.50871 6.93798 8.4275 5.55396 8.39635 numMergedOcc 0
