0 mol 1 unq 0 iso 0 dist 8.3673 11.5998 7.68226 5.84337 6.86701 7.29854 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 9.06787 18.2881 9.31516 5.87231 7.28228 14.9509 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.76815 5.98831 6.37273 11.0447 9.8703 8.66168 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 8.76815 5.98831 6.37273 5.4779 7.39665 7.1369 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.85892 5.93093 5.79157 11.4473 8.72682 5.72472 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 5.65006 13.2269 9.3711 5.27863 8.23026 14.388 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 9.54537 6.68601 6.89706 14.437 7.51139 8.44462 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 9.54537 6.68601 6.89706 4.31214 7.80898 6.07226 numMergedOcc 0
8 mol 105 unq 0 iso 0 dist 7.85265 13.0911 9.11206 9.7247 9.16718 7.16724 numMergedOcc 0
9 mol 105 unq 1 iso 0 dist 7.85265 13.0911 9.11206 6.37983 7.94633 7.70748 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 8.59002 15.6545 9.58666 10.2526 7.7988 6.64056 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 8.59002 15.6545 9.58666 12.1073 9.40824 6.29647 numMergedOcc 0
12 mol 112 unq 2 iso 0 dist 8.59002 15.6545 9.58666 6.7184 4.22363 9.6717 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 9.11877 5.77495 5.44814 6.99924 5.37047 5.4432 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 9.19254 10.4685 9.95076 4.7924 7.37333 8.35998 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 5.09756 6.28015 9.82338 5.01462 8.90571 9.653 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 5.09756 6.28015 9.82338 6.15341 6.61112 10.568 numMergedOcc 0
17 mol 211 unq 0 iso 0 dist 5.75044 5.70694 6.69877 4.08758 6.28595 6.13472 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 7.79613 4.86004 5.07975 5.02064 5.56538 5.66819 numMergedOcc 0
19 mol 243 unq 0 iso 0 dist 7.42359 11.9134 8.07313 13.504 8.69318 5.14134 numMergedOcc 0
20 mol 243 unq 1 iso 0 dist 6.02146 4.57371 7.89993 11.8651 8.67156 12.7467 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 8.76085 5.62156 5.81865 9.4018 8.83833 5.86413 numMergedOcc 0
22 mol 257 unq 1 iso 0 dist 8.76085 8.86253 8.25457 9.4018 8.83833 13.8679 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 9.51394 4.62662 9.94851 6.89449 7.45616 8.96892 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 9.51394 4.62662 9.94851 6.89449 7.45616 8.96892 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 9.51394 4.62662 9.94851 6.89449 7.45616 8.96892 numMergedOcc 0
