0 mol 38 unq 0 iso 0 dist 9.28363 6.13482 7.57586 9.55914 6.19943 7.68478 numMergedOcc 0
1 mol 75 unq 0 iso 0 dist 9.66481 10.4239 7.16583 11.4295 4.79348 9.16597 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 9.43893 9.0996 9.99029 15.8267 17.7256 7.91148 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 9.43893 9.0996 9.99029 14.6024 15.9158 6.59794 numMergedOcc 0
4 mol 78 unq 2 iso 0 dist 9.43893 9.0996 9.99029 15.7208 17.574 8.34957 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 9.22704 4.98967 5.49623 6.29267 6.51961 5.25027 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 9.22704 4.98967 5.49623 8.85201 4.08459 4.37025 numMergedOcc 0
7 mol 162 unq 0 iso 0 dist 8.07461 12.3285 9.89142 14.7297 7.86779 7.93088 numMergedOcc 0
8 mol 162 unq 1 iso 0 dist 8.07461 5.88416 8.06091 13.6935 10.5848 8.94224 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 7.04009 7.01116 8.58946 14.2344 11.6251 9.86868 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 7.04009 7.01116 8.58946 10.3354 6.39898 6.83528 numMergedOcc 0
11 mol 174 unq 0 iso 0 dist 8.46781 6.67451 4.93781 10.9418 6.16051 5.61673 numMergedOcc 0
12 mol 218 unq 0 iso 0 dist 5.51354 6.75711 9.88212 9.08818 10.5477 6.1896 numMergedOcc 0
13 mol 218 unq 1 iso 0 dist 5.51354 6.75711 9.88212 11.1546 11.445 6.09255 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.88518 5.29393 9.67877 4.98907 13.3447 8.03012 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 9.70632 4.97892 7.72749 11.727 6.91113 8.97531 numMergedOcc 0
16 mol 294 unq 0 iso 0 dist 9.23009 5.08625 8.52208 6.44588 5.13965 7.56669 numMergedOcc 0
