0 mol 1 unq 0 iso 0 dist 8.32001 7.40421 7.81034 5.06877 9.21329 4.93091 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 9.72316 6.29622 7.17889 5.61824 9.86496 6.6276 numMergedOcc 0
2 mol 37 unq 1 iso 0 dist 9.72316 6.55499 8.38803 5.61824 9.86496 10.8321 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.93754 3.71335 6.69184 15.1192 7.9575 12.7379 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 4.65085 6.03473 8.92491 9.31017 9.50939 13.3471 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 4.65085 6.68667 7.41861 9.31017 9.50939 9.68005 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 9.37079 8.19323 8.17814 10.7147 9.58166 8.48716 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 9.37079 8.4137 9.14434 10.7147 9.58166 16.3356 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.00286 6.39132 6.9268 6.67951 8.98028 8.4707 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 9.00286 10.5646 8.19166 6.67951 8.98028 6.42838 numMergedOcc 0
10 mol 157 unq 0 iso 0 dist 6.11979 9.55356 8.78412 6.77125 9.46735 6.11737 numMergedOcc 0
11 mol 159 unq 0 iso 0 dist 9.03375 12.9605 7.52779 7.26594 8.61788 10.3725 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 7.74806 5.19872 6.97662 7.29197 6.35772 7.99586 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 9.42656 5.90059 9.84479 3.81838 9.36462 6.5573 numMergedOcc 0
14 mol 232 unq 1 iso 0 dist 9.81337 10.0194 9.84479 3.8851 9.36462 6.5573 numMergedOcc 0
15 mol 232 unq 2 iso 0 dist 8.28746 12.037 9.82645 7.19741 5.86945 5.28999 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 9.5431 13.7768 7.20629 12.3808 9.8976 5.33407 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 9.5431 13.7768 7.20629 5.83819 7.97911 9.06901 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 9.5431 3.81516 9.44671 12.3808 9.8976 10.6613 numMergedOcc 0
19 mol 233 unq 3 iso 0 dist 9.5431 3.81516 9.44671 5.83819 7.97911 4.45501 numMergedOcc 0
20 mol 233 unq 4 iso 0 dist 6.39109 3.81516 7.21531 6.09795 8.70416 7.70097 numMergedOcc 0
21 mol 233 unq 5 iso 0 dist 6.39109 3.81516 7.21531 9.00401 8.18379 10.2345 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 9.43397 10.7844 4.53228 5.02193 5.4687 6.29809 numMergedOcc 0
23 mol 239 unq 1 iso 0 dist 9.43397 10.2329 8.54078 5.02193 5.4687 8.19053 numMergedOcc 0
