0 mol 13 unq 0 iso 0 dist 7.71544 9.37413 11.4587 6.54276 4.43066 12.1185 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 7.71544 9.18487 4.14738 6.54276 4.43066 7.98465 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.6112 8.62693 6.66387 5.23054 9.63803 5.84066 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 9.59131 8.91418 5.14132 9.00425 8.0072 7.29079 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 4.67917 8.17564 8.85727 5.38738 8.35477 10.8708 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 6.88924 7.19213 8.85727 3.68445 8.35477 10.8708 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 7.74131 9.28803 9.59811 3.80156 8.59739 12.7886 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 8.36326 6.64631 4.41983 10.1179 9.70292 10.8228 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 8.36326 6.64631 4.41983 11.97 9.59704 13.0863 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.64946 6.73897 6.11049 3.75291 9.76097 8.50705 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 6.91762 8.02593 4.40049 5.05961 7.25009 5.36254 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 7.74693 7.83363 5.3674 4.98419 8.7831 8.24424 numMergedOcc 0
12 mol 233 unq 1 iso 0 dist 7.74693 7.83363 5.3674 7.08719 9.61071 7.0942 numMergedOcc 0
13 mol 233 unq 2 iso 0 dist 7.74693 7.83363 5.3674 10.7478 7.1229 6.01775 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 9.51177 9.46582 13.1765 5.17342 6.96382 7.39547 numMergedOcc 0
15 mol 238 unq 1 iso 0 dist 9.51177 9.77231 14.6367 5.17342 6.96382 10.0287 numMergedOcc 0
16 mol 285 unq 0 iso 0 dist 8.12306 8.96754 10.7671 7.22841 8.69325 14.0227 numMergedOcc 0
17 mol 285 unq 1 iso 0 dist 8.12306 8.96754 10.7671 6.01574 5.09181 12.8128 numMergedOcc 0
