0 mol 20 unq 0 iso 0 dist 9.62492 9.37411 3.63394 9.00405 10.1439 7.47395 11.2079 4.90916 4.7579 7.99756 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.62492 9.37411 3.63394 9.00405 10.1439 7.47395 8.98326 6.3965 3.21365 4.36087 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 8.67226 9.37411 5.17224 9.00405 7.17695 7.47395 11.2079 9.45728 4.7579 7.99756 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 8.67226 9.37411 5.17224 9.00405 7.17695 7.47395 8.98326 4.76485 3.21365 4.36087 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 9.073 7.51631 10.0937 8.24064 14.5952 7.7485 6.09085 6.4113 7.18877 8.71074 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 7.92498 6.61697 7.1034 5.70681 11.0815 5.31126 12.4669 14.7343 9.59189 8.67025 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 7.92498 6.61697 7.1034 5.08157 11.8871 7.16619 14.6461 20.3225 13.8379 9.60127 numMergedOcc 0
7 mol 169 unq 0 iso 0 dist 8.11268 6.85177 7.16323 5.73931 10.9108 5.10589 12.8818 14.8524 9.60496 8.6961 numMergedOcc 0
8 mol 169 unq 1 iso 0 dist 8.11268 8.88729 11.9514 5.73931 10.9108 4.63336 12.8818 14.8524 10.5251 8.6961 numMergedOcc 0
9 mol 169 unq 2 iso 0 dist 9.19569 7.07933 5.74428 12.9917 9.58901 6.96715 8.89822 7.0638 3.59996 4.11374 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 9.19343 8.47283 4.71133 10.816 10.0199 9.93489 6.51936 3.72636 4.05102 7.33774 numMergedOcc 0
11 mol 204 unq 1 iso 0 dist 9.19343 8.47283 4.71133 4.27546 9.90861 7.64057 6.51936 3.72636 4.05102 6.39122 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 7.46 8.90109 3.43711 8.71923 7.88108 7.04263 14.8324 9.0549 8.22506 8.51564 numMergedOcc 0
13 mol 260 unq 1 iso 0 dist 6.71406 8.90109 7.63469 8.71923 12.0301 7.04263 14.8324 14.458 8.22506 8.51564 numMergedOcc 0
14 mol 285 unq 0 iso 0 dist 5.77107 5.93983 5.00843 8.32005 10.1649 5.88958 7.12723 8.02755 3.14843 4.27826 numMergedOcc 0
15 mol 285 unq 1 iso 0 dist 5.77107 5.93983 5.00843 7.07384 11.3128 7.78121 7.12723 8.02755 3.14843 5.82074 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.35178 8.27196 9.94473 4.69872 9.40443 6.24487 11.1329 8.85995 5.55422 8.32982 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 8.35178 8.27196 9.94473 4.69872 9.40443 6.24487 11.1329 8.85995 5.55422 8.32982 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 8.35178 8.27196 9.94473 4.69872 9.40443 6.24487 11.1329 8.85995 5.55422 8.32982 numMergedOcc 0
