0 mol 34 unq 0 iso 0 dist 6.88388 5.0047 7.27883 8.74894 6.93364 12.2054 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 6.88388 5.0047 7.27883 6.0282 6.34821 9.09489 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 5.19329 4.73783 9.46302 6.0472 8.65019 8.88127 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 6.19716 6.70013 7.81334 8.99181 8.69209 5.72925 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 8.1489 4.73724 7.81334 6.10692 8.69209 5.72925 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 4.35437 5.41685 7.86269 7.88117 7.54496 4.97513 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 9.67232 4.77158 9.27951 11.043 8.43028 9.70923 numMergedOcc 0
7 mol 146 unq 0 iso 0 dist 9.47441 10.0156 5.04351 8.97243 8.1069 6.04249 numMergedOcc 0
8 mol 146 unq 1 iso 0 dist 9.47441 10.0156 5.04351 16.7633 8.68349 9.77501 numMergedOcc 0
9 mol 146 unq 2 iso 0 dist 8.72978 6.87502 5.04351 6.7288 8.1069 6.04249 numMergedOcc 0
10 mol 146 unq 3 iso 0 dist 8.72978 6.87502 5.04351 15.4146 8.68349 9.77501 numMergedOcc 0
11 mol 146 unq 4 iso 0 dist 8.956 10.3513 5.04351 6.29253 8.1069 6.04249 numMergedOcc 0
12 mol 146 unq 5 iso 0 dist 8.956 10.3513 5.04351 10.8638 8.68349 9.77501 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 8.65878 8.6549 6.92225 10.3704 6.39981 5.49464 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 8.26119 13.7534 7.47107 17.2935 9.77862 11.5684 numMergedOcc 0
15 mol 194 unq 1 iso 0 dist 9.10338 13.5452 7.47107 7.32655 9.77862 11.5684 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 8.1139 7.97874 9.86462 9.04724 6.23898 6.34706 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 7.55355 8.90714 8.28454 8.12068 7.29542 8.59036 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 7.96696 8.8772 8.81373 10.0929 7.18771 6.0331 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 7.96696 8.8772 8.81373 11.9014 7.94894 4.9045 numMergedOcc 0
20 mol 250 unq 0 iso 0 dist 5.01762 8.92996 9.43554 8.43014 8.70484 14.0983 numMergedOcc 0
21 mol 250 unq 1 iso 0 dist 5.01762 8.76762 9.21681 8.43014 8.70484 10.9117 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 9.84667 11.9929 8.28871 4.52597 9.42738 9.63193 numMergedOcc 0
23 mol 264 unq 1 iso 0 dist 9.84667 14.4117 7.94668 4.52597 9.42738 12.2052 numMergedOcc 0
24 mol 270 unq 0 iso 0 dist 7.90419 8.32836 8.05859 8.02435 6.31869 12.734 numMergedOcc 0
