0 mol 10 unq 0 iso 0 dist 9.9373 8.30337 8.3613 7.83087 3.3748 9.33141 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.4881 8.41861 8.3613 9.37129 3.3748 9.33141 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 9.97671 14.6965 9.33141 11.7194 3.3748 8.3613 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 7.83087 8.30337 9.33141 9.9373 3.3748 8.3613 numMergedOcc 0
4 mol 10 unq 4 iso 0 dist 9.37129 8.41861 9.33141 8.4881 3.3748 8.3613 numMergedOcc 0
5 mol 11 unq 0 iso 0 dist 5.47299 10.0791 6.84216 16.9297 14.8738 8.68293 numMergedOcc 0
6 mol 11 unq 1 iso 0 dist 5.40468 9.68915 6.58046 15.4433 13.3327 8.01262 numMergedOcc 0
7 mol 26 unq 0 iso 0 dist 6.70325 5.71065 7.98005 10.4308 6.92384 8.31381 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 7.33788 8.8671 8.89047 11.9578 6.87266 7.15542 numMergedOcc 0
9 mol 48 unq 1 iso 0 dist 7.33788 8.8671 8.89047 9.51079 3.23184 8.89003 numMergedOcc 0
10 mol 48 unq 2 iso 0 dist 8.52681 12.9129 8.89047 13.8065 6.87266 7.15542 numMergedOcc 0
11 mol 48 unq 3 iso 0 dist 8.52681 12.9129 8.89047 10.084 3.23184 8.89003 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 7.50229 5.73349 8.97888 10.009 3.46822 9.85512 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 8.67342 7.96997 7.69926 8.60062 2.58673 5.85237 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 8.60062 7.96997 5.85237 8.67342 2.58673 7.69926 numMergedOcc 0
15 mol 85 unq 2 iso 0 dist 5.73739 9.51195 7.69926 5.16225 2.58673 5.85237 numMergedOcc 0
16 mol 85 unq 3 iso 0 dist 5.16225 9.51195 5.85237 5.73739 2.58673 7.69926 numMergedOcc 0
17 mol 109 unq 0 iso 0 dist 9.87557 6.66379 8.11702 13.9247 9.99088 7.44558 numMergedOcc 0
18 mol 117 unq 0 iso 0 dist 8.71826 6.29657 7.78789 13.3754 9.77711 7.42146 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 8.52131 14.5814 7.59457 12.1038 6.01609 6.79114 numMergedOcc 0
20 mol 167 unq 0 iso 0 dist 7.20131 4.70374 6.83528 13.5665 9.71457 9.86868 numMergedOcc 0
21 mol 167 unq 1 iso 0 dist 9.98672 6.05722 9.86868 12.1023 9.71457 6.83528 numMergedOcc 0
22 mol 167 unq 2 iso 0 dist 7.84707 8.90206 9.86868 13.2277 9.71457 6.83528 numMergedOcc 0
23 mol 168 unq 0 iso 0 dist 5.80055 10.9775 8.92592 7.44481 3.44823 9.57452 numMergedOcc 0
24 mol 168 unq 1 iso 0 dist 7.44481 10.9775 9.57452 5.80055 3.44823 8.92592 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 6.90511 7.48984 5.4557 12.2102 8.40845 7.12221 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 9.07744 7.94155 5.69112 12.4905 3.75238 7.2091 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 8.42892 13.5116 5.69112 9.71221 3.75238 7.2091 numMergedOcc 0
28 mol 277 unq 2 iso 0 dist 8.90967 7.72525 5.69112 6.40861 3.75238 7.2091 numMergedOcc 0
29 mol 277 unq 3 iso 0 dist 6.40861 7.72525 7.2091 8.90967 3.75238 5.69112 numMergedOcc 0
30 mol 281 unq 0 iso 0 dist 9.39268 7.85489 5.50053 12.8134 3.77058 7.33334 numMergedOcc 0
31 mol 281 unq 1 iso 0 dist 9.06888 8.21418 5.50053 6.62682 3.77058 7.33334 numMergedOcc 0
32 mol 281 unq 2 iso 0 dist 6.62682 8.21418 7.33334 9.06888 3.77058 5.50053 numMergedOcc 0
33 mol 292 unq 0 iso 0 dist 6.37248 4.81126 5.41432 13.5885 8.12358 9.96374 numMergedOcc 0
