0 mol 48 unq 0 iso 0 dist 9.14072 9.90363 5.06188 5.41774 4.55422 7.78899 7.34462 8.5859 6.47086 7.95815 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 8.92491 8.04327 5.73235 13.408 6.1999 6.14248 20.2391 13.4333 13.4778 9.3711 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 8.92491 14.685 7.48127 13.408 6.1999 6.97936 20.2391 13.4333 15.1961 9.3711 numMergedOcc 0
3 mol 76 unq 2 iso 0 dist 7.41861 7.7047 5.73235 6.63973 6.1999 6.14248 15.9053 13.4333 13.4778 9.3711 numMergedOcc 0
4 mol 76 unq 3 iso 0 dist 7.41861 4.00834 7.48127 6.63973 6.1999 6.97936 15.9053 13.4333 15.1961 9.3711 numMergedOcc 0
5 mol 139 unq 0 iso 0 dist 9.71665 5.61614 9.70154 7.02063 3.82037 6.79625 7.41954 8.66615 10.5769 9.07404 numMergedOcc 0
6 mol 139 unq 1 iso 0 dist 9.71665 4.94393 8.78382 7.02063 3.82037 7.20542 7.41954 8.66615 6.5333 9.07404 numMergedOcc 0
7 mol 192 unq 0 iso 0 dist 5.21088 4.65303 7.36571 7.93715 6.62595 5.77035 12.2163 14.2876 7.66978 9.19818 numMergedOcc 0
8 mol 192 unq 1 iso 0 dist 8.25609 4.65303 9.17137 7.93715 12.1003 5.77035 12.2163 15.2627 7.66978 9.19818 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 9.04342 4.03375 5.61326 10.3127 4.3166 7.75518 6.6228 6.77515 6.15002 5.08438 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 8.47833 11.2438 6.43519 12.239 10.4922 5.63283 17.9365 12.7548 6.89035 8.71347 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 5.47586 7.47443 6.43519 8.69512 10.4922 5.63283 14.2869 12.7548 6.89035 8.71347 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 9.51001 11.094 4.71683 17.9225 10.7395 9.67162 19.9815 13.6596 10.1358 6.92437 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 4.53228 6.54316 7.58554 7.96523 7.26668 7.98794 9.67509 11.2673 10.6145 5.68578 numMergedOcc 0
14 mol 239 unq 1 iso 0 dist 4.53228 6.54316 7.58554 7.96523 7.26668 7.98794 13.9346 13.0427 8.52005 9.50933 numMergedOcc 0
15 mol 239 unq 2 iso 0 dist 8.54078 6.2497 7.58554 12.4753 7.26668 7.98794 14.2074 11.2673 10.6145 5.68578 numMergedOcc 0
16 mol 239 unq 3 iso 0 dist 8.54078 6.2497 7.58554 12.4753 7.26668 7.98794 14.631 13.0427 8.52005 9.50933 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.3388 5.66584 6.96774 9.27722 3.85958 7.19568 7.51649 8.05825 4.38561 9.5356 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 6.96248 5.66584 7.14859 9.27722 5.93557 7.19568 7.51649 11.0609 4.38561 9.5356 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.3388 5.66584 6.96774 9.27722 3.85958 7.19568 7.51649 8.05825 4.38561 9.5356 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 6.96248 5.66584 7.14859 9.27722 5.93557 7.19568 7.51649 11.0609 4.38561 9.5356 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.3388 5.66584 6.96774 9.27722 3.85958 7.19568 7.51649 8.05825 4.38561 9.5356 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 6.96248 5.66584 7.14859 9.27722 5.93557 7.19568 7.51649 11.0609 4.38561 9.5356 numMergedOcc 0
