0 mol 7 unq 0 iso 0 dist 7.7393 8.23909 4.92824 13.823 13.7022 9.60499 13.7145 10.4566 6.02702 8.43473 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.51574 8.47315 11.0043 5.59769 12.359 4.7319 12.1062 17.515 6.72833 6.51133 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 9.39137 8.47315 6.73304 5.59769 9.29952 4.7319 12.1062 12.9501 6.72833 6.51133 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 9.40633 6.49205 6.83988 5.19198 12.1173 6.18601 6.25204 5.58734 8.00003 10.4376 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 9.95698 9.42766 7.09701 14.0677 15.5777 8.73993 13.1831 13.0609 6.52773 7.20179 numMergedOcc 0
5 mol 119 unq 2 iso 0 dist 9.95698 9.42766 7.09701 14.0677 15.5777 8.73993 6.34278 12.5388 9.23858 9.89358 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 6.00391 7.83619 11.8666 10.0837 16.086 9.28393 7.91054 13.0056 7.96646 6.73735 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 9.70695 7.83619 5.15286 10.0837 10.2741 9.28393 7.91054 5.96506 7.96646 6.73735 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.43088 6.11955 6.43447 7.96098 10.4418 6.80239 4.7146 10.5945 5.87634 4.54648 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 9.58724 9.8711 14.6296 4.90657 7.31105 9.23153 4.39102 12.6669 6.59716 7.11498 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 9.92855 9.84492 7.49004 11.9226 15.1936 8.22528 10.8309 13.8962 8.66332 6.65022 numMergedOcc 0
11 mol 234 unq 0 iso 0 dist 6.41452 5.00515 4.93539 5.16023 10.9041 8.41436 6.63685 10.7062 6.30154 7.44558 numMergedOcc 0
12 mol 234 unq 1 iso 0 dist 6.41452 5.00515 4.93539 5.16023 10.9041 8.41436 10.6768 10.5552 7.32499 10.7902 numMergedOcc 0
13 mol 234 unq 2 iso 0 dist 6.41452 5.00515 4.93539 10.2063 11.598 8.92474 6.63685 10.7062 6.30154 10.9712 numMergedOcc 0
14 mol 234 unq 3 iso 0 dist 6.41452 5.00515 4.93539 10.2063 11.598 8.92474 10.6768 10.5552 7.32499 4.4288 numMergedOcc 0
15 mol 248 unq 0 iso 0 dist 9.39764 7.66519 6.12544 6.42363 12.4697 9.56569 5.81577 8.53033 7.16525 4.30004 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 5.12827 9.82774 9.40662 10.5903 13.774 8.44326 11.9007 14.3692 8.00673 4.97614 numMergedOcc 0
