0 mol 29 unq 0 iso 0 dist 9.99467 5.97548 5.36278 8.03211 9.78134 5.3571 10.2037 8.02814 7.71924 7.71617 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.04514 9.66389 5.35252 12.2639 8.8645 5.76698 11.1779 5.03338 7.38928 12.5606 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.82294 7.89444 5.66803 14.2658 7.11238 7.91421 12.8981 5.88036 6.08228 8.13162 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 9.82294 18.0124 8.85416 14.2658 7.11238 5.48409 12.8981 5.88036 9.86958 8.13162 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.98208 12.456 4.34694 15.1815 7.47162 4.93697 18.4312 9.65371 8.4438 7.75341 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 5.55798 6.05149 8.64686 4.95654 7.82966 7.18389 8.71103 9.57704 7.41952 12.7824 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 5.55798 6.05149 8.64686 10.0025 8.26763 11.5374 8.71103 9.57704 7.41952 16.3634 numMergedOcc 0
7 mol 79 unq 2 iso 0 dist 5.55798 6.05149 8.64686 6.35003 6.30814 5.21981 8.71103 9.57704 7.41952 10.7273 numMergedOcc 0
8 mol 79 unq 3 iso 0 dist 5.55798 6.05149 8.64686 3.45432 7.318 8.12985 8.71103 9.57704 7.41952 8.0318 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 8.79677 11.5575 6.54778 13.0649 8.40389 5.33859 11.3418 4.84565 9.6874 12.707 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 8.80952 11.2678 9.96635 6.34731 7.68074 7.76298 11.946 10.9312 7.07348 12.0644 numMergedOcc 0
11 mol 158 unq 1 iso 0 dist 8.80952 11.2678 9.96635 15.1374 9.1854 8.17573 11.946 10.9312 7.07348 13.0344 numMergedOcc 0
12 mol 159 unq 0 iso 0 dist 7.52779 10.242 9.9368 7.44399 9.45909 15.7186 12.5372 13.4546 7.60912 19.6156 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 6.36789 12.6035 6.72718 9.03587 8.09915 13.4486 9.89709 6.12748 7.02662 13.507 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 6.96248 5.66584 7.14859 11.9352 8.43856 13.8618 12.4464 8.13485 8.0935 14.152 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 6.96248 5.66584 7.14859 11.9352 8.43856 13.8618 12.4464 8.13485 8.0935 14.152 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 6.96248 5.66584 7.14859 11.9352 8.43856 13.8618 12.4464 8.13485 8.0935 14.152 numMergedOcc 0
