0 mol 24 unq 0 iso 0 dist 8.86116 6.72502 6.58998 5.11636 7.95042 8.24948 9.30028 15.4638 13.3652 7.7447 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.38394 6.72502 6.59374 5.11636 10.9819 8.24948 9.30028 17.3778 13.3652 7.7447 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.34347 8.44506 13.2876 7.11305 14.8317 6.38243 7.98005 12.5438 12.4814 8.97754 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 6.64012 7.27383 6.37648 4.00553 9.08221 6.87028 6.79356 5.87468 6.21346 9.10675 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 7.17396 8.64015 11.0904 6.08003 12.4823 7.17026 9.45821 13.9452 4.74563 6.23509 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 9.21998 8.64015 12.9211 6.08003 13.2239 7.17026 9.45821 16.3616 4.74563 6.23509 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 7.71338 6.43433 8.56707 6.95317 8.47988 4.99604 6.87434 4.69658 4.25001 5.92828 numMergedOcc 0
7 mol 112 unq 1 iso 0 dist 9.60462 9.92283 17.3924 10.9279 19.9429 4.99604 11.5809 19.2759 4.25001 5.92828 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.73993 7.77116 3.78311 6.9194 12.31 9.6121 10.1864 13.2169 10.7475 4.55071 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 7.12972 6.92648 9.32969 8.57203 14.4508 6.78801 15.2551 18.9041 9.93041 8.49847 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 6.85062 9.29384 9.32969 12.6005 14.4508 6.78801 18.8134 18.9041 9.93041 8.49847 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 8.94367 8.20836 9.4027 16.4114 14.3561 8.48313 20.8896 19.054 12.7348 4.94473 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 9.86662 8.20836 5.12325 16.4114 9.71716 8.48313 20.8896 13.8188 12.7348 4.94473 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 5.87555 8.35555 5.59336 4.94983 6.70693 7.1069 6.79114 4.68615 4.78989 8.60651 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 8.87437 8.35555 10.9728 4.94983 10.4895 7.1069 6.79114 9.35878 4.78989 8.60651 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.09754 8.64409 9.97575 12.6058 17.9507 8.57801 17.3863 18.5746 9.28201 8.92135 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 6.00706 7.862 6.42798 8.84507 6.74196 7.97027 11.04 5.17002 9.06039 9.79673 numMergedOcc 0
17 mol 222 unq 1 iso 0 dist 6.00706 7.862 6.42798 8.84507 6.74196 7.97027 10.2446 6.70898 3.98816 6.39673 numMergedOcc 0
18 mol 222 unq 2 iso 0 dist 6.00706 7.862 6.42798 6.02502 8.36842 4.9876 10.2446 6.70898 3.98816 7.80676 numMergedOcc 0
19 mol 252 unq 0 iso 0 dist 8.1148 6.11473 9.32326 5.6214 13.1298 9.39658 11.065 17.1704 10.4138 7.62991 numMergedOcc 0
20 mol 252 unq 1 iso 0 dist 8.1148 6.11473 9.32326 5.6214 13.1298 9.39658 14.2216 20.6661 19.1465 9.81261 numMergedOcc 0
21 mol 252 unq 2 iso 0 dist 8.1148 6.53679 11.056 5.6214 13.1298 5.9974 11.065 17.1704 6.33781 7.62991 numMergedOcc 0
22 mol 252 unq 3 iso 0 dist 8.1148 6.53679 11.056 5.6214 13.1298 5.9974 14.2216 20.6661 14.8966 9.81261 numMergedOcc 0
23 mol 252 unq 4 iso 0 dist 8.1715 6.11473 5.72783 5.6214 10.5687 9.39658 11.065 10.5966 10.4138 7.62991 numMergedOcc 0
24 mol 252 unq 5 iso 0 dist 8.1715 6.11473 5.72783 5.6214 10.5687 9.39658 14.2216 19.6445 19.1465 9.81261 numMergedOcc 0
25 mol 252 unq 6 iso 0 dist 8.1715 6.53679 5.23748 5.6214 10.5687 5.9974 11.065 10.5966 6.33781 7.62991 numMergedOcc 0
26 mol 252 unq 7 iso 0 dist 8.1715 6.53679 5.23748 5.6214 10.5687 5.9974 14.2216 19.6445 14.8966 9.81261 numMergedOcc 0
27 mol 252 unq 8 iso 0 dist 8.33025 7.50201 11.056 7.40852 13.1298 5.9974 12.8652 17.1704 6.33781 7.62991 numMergedOcc 0
28 mol 252 unq 9 iso 0 dist 8.33025 7.50201 11.056 7.40852 13.1298 5.9974 12.9602 20.6661 14.8966 9.81261 numMergedOcc 0
29 mol 252 unq 10 iso 0 dist 9.2288 7.50201 5.23748 7.40852 10.5687 5.9974 12.8652 10.5966 6.33781 7.62991 numMergedOcc 0
30 mol 252 unq 11 iso 0 dist 9.2288 7.50201 5.23748 7.40852 10.5687 5.9974 12.9602 19.6445 14.8966 9.81261 numMergedOcc 0
31 mol 252 unq 12 iso 0 dist 7.19638 7.50201 7.63376 7.40852 7.15764 5.9974 12.8652 9.73449 6.33781 7.62991 numMergedOcc 0
32 mol 252 unq 13 iso 0 dist 7.19638 7.50201 7.63376 7.40852 7.15764 5.9974 12.9602 9.93981 14.8966 9.81261 numMergedOcc 0
33 mol 264 unq 0 iso 0 dist 9.17653 6.14323 13.0621 13.2035 19.5824 7.14086 13.9142 20.0515 9.4435 8.55386 numMergedOcc 0
