0 mol 16 unq 0 iso 0 dist 9.04834 8.17898 10.2656 9.19152 6.28033 12.3978 6.05535 4.7319 11.0958 5.40044 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 4.24428 6.30194 5.7113 6.13631 6.10011 8.124 6.58444 5.93252 11.379 8.3449 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 6.30194 4.24428 5.7113 6.13631 8.124 6.10011 10.5627 6.19304 11.4799 13.4367 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 7.118 8.24814 5.64643 10.7293 8.2147 13.0332 5.06305 7.79912 8.56639 13.5815 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 8.35604 8.93552 10.2788 9.50302 6.55511 11.7088 5.3967 5.11551 11.2489 5.47689 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 8.35604 8.93552 10.2788 9.50302 6.55511 11.7088 11.9798 7.11972 16.1842 6.00348 numMergedOcc 0
6 mol 115 unq 2 iso 0 dist 7.83568 6.20658 10.2788 6.0336 6.55511 11.7088 7.10772 5.11551 11.2489 5.47689 numMergedOcc 0
7 mol 115 unq 3 iso 0 dist 7.83568 6.20658 10.2788 6.0336 6.55511 11.7088 11.3906 7.11972 16.1842 6.00348 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 5.67862 7.97208 5.00817 6.50741 7.27598 5.57904 9.52819 6.37586 6.49416 6.50005 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 5.67862 7.97208 5.00817 6.50741 7.27598 5.57904 12.4156 9.71307 12.5075 12.0971 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 7.97208 5.67862 5.00817 6.50741 5.57904 7.27598 12.5576 6.54501 9.5126 7.41837 numMergedOcc 0
11 mol 134 unq 3 iso 0 dist 7.97208 5.67862 5.00817 6.50741 5.57904 7.27598 9.52819 6.49416 6.37586 6.50005 numMergedOcc 0
12 mol 230 unq 0 iso 0 dist 9.12305 9.30906 5.46301 11.2815 5.62804 9.3619 9.0274 6.7547 11.5044 6.33989 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 7.9357 5.79537 5.30627 7.88062 8.21585 10.6274 8.73372 6.42289 10.1675 5.13233 numMergedOcc 0
14 mol 258 unq 1 iso 0 dist 8.81059 9.67877 17.2075 5.79358 8.21585 12.6095 9.78068 6.42289 17.2071 5.13233 numMergedOcc 0
15 mol 258 unq 2 iso 0 dist 8.81059 9.12006 5.30627 5.79358 8.21585 10.6274 9.78068 6.42289 10.1675 5.13233 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 7.15785 9.43169 5.51688 5.72823 9.95681 9.05762 6.5875 8.02547 6.05727 5.79827 numMergedOcc 0
17 mol 261 unq 1 iso 0 dist 9.43169 7.15785 5.51688 5.72823 9.05762 9.95681 6.5875 6.05727 8.02547 5.79827 numMergedOcc 0
18 mol 272 unq 0 iso 0 dist 6.62923 4.78812 5.40809 11.1133 7.31993 12.3168 11.9042 9.97651 13.2494 7.33684 numMergedOcc 0
19 mol 272 unq 1 iso 0 dist 6.62923 4.78812 5.40809 11.1133 7.31993 12.3168 5.27123 8.46116 8.33638 10.4451 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 8.3291 9.79674 9.12834 9.34663 8.78883 15.4145 6.98398 9.10818 15.2761 7.48637 numMergedOcc 0
