0 mol 48 unq 0 iso 0 dist 6.04551 6.8073 6.62574 15.0431 9.54119 12.7368 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 6.04551 6.8073 6.62574 4.92775 7.87476 5.89173 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 6.04551 5.60663 9.48836 15.0431 9.54119 18.9117 numMergedOcc 0
3 mol 48 unq 3 iso 0 dist 6.04551 5.60663 9.48836 4.92775 7.87476 9.6736 numMergedOcc 0
4 mol 48 unq 4 iso 0 dist 8.28883 8.68989 3.95005 5.29743 7.37491 8.40186 numMergedOcc 0
5 mol 48 unq 5 iso 0 dist 6.01454 6.42242 6.98858 15.1442 9.77004 13.1918 numMergedOcc 0
6 mol 48 unq 6 iso 0 dist 6.01454 6.42242 6.98858 4.89976 8.36323 5.72703 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 9.35912 5.55574 8.07336 5.04771 9.21258 9.50826 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 8.67865 6.15654 9.52463 10.8271 7.80279 14.8897 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 8.67865 7.89887 6.07224 10.8271 7.80279 11.07 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 8.63522 9.2062 6.69798 6.04036 9.49592 6.07633 numMergedOcc 0
11 mol 102 unq 1 iso 0 dist 5.43401 9.2062 5.6591 6.04036 5.88034 6.07633 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.56593 8.71007 4.8653 9.65579 7.53168 6.90583 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 8.56593 8.71007 4.8653 5.93647 5.18805 6.75593 numMergedOcc 0
14 mol 141 unq 2 iso 0 dist 8.56593 8.71007 4.8653 8.51016 7.11158 8.83562 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 5.97008 9.31172 14.253 8.29493 9.26806 14.0859 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 9.45847 4.88303 13.3059 4.75805 8.98606 5.12964 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 8.51118 9.87211 4.91904 11.048 7.06868 11.7004 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 8.51118 6.3997 7.59634 11.048 7.06868 13.216 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 6.82688 8.27761 5.39184 11.775 9.69133 9.78273 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 6.51449 8.64133 11.0338 7.74446 9.93591 10.6444 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 8.61786 9.54381 5.4894 6.09382 9.92035 9.32971 numMergedOcc 0
22 mol 268 unq 0 iso 0 dist 6.74419 7.40731 5.28541 9.62272 8.69312 9.6128 numMergedOcc 0
23 mol 280 unq 0 iso 0 dist 9.05509 7.42529 11.0648 11.2705 8.9318 13.412 numMergedOcc 0
24 mol 285 unq 0 iso 0 dist 8.70702 9.26309 15.698 5.42273 8.26827 10.4991 numMergedOcc 0
25 mol 285 unq 1 iso 0 dist 9.3482 9.26309 4.79097 5.42273 7.9002 10.4991 numMergedOcc 0
