0 mol 18 unq 0 iso 0 dist 7.23594 5.03451 10.0997 6.05493 9.1397 10.5736 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.15677 5.03531 6.33493 12.9455 7.98005 10.2035 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.15677 5.03531 6.33493 14.2359 8.31381 13.0668 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 8.2513 9.942 16.0486 4.38299 9.45756 13.7135 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 8.2513 5.92771 9.26597 4.38299 9.45756 3.77542 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 6.27528 7.07055 5.54818 4.29847 9.83836 11.276 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 6.27528 7.07055 5.54818 8.0664 9.58351 12.4019 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 8.87148 9.85144 6.21159 8.75597 8.111 5.36214 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 9.26057 6.60464 6.21159 6.36283 8.111 5.36214 numMergedOcc 0
9 mol 136 unq 0 iso 0 dist 6.53519 7.75661 4.22085 4.3516 9.92504 11.0683 numMergedOcc 0
10 mol 136 unq 1 iso 0 dist 6.53519 7.75661 4.22085 4.25637 9.96485 11.9032 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 8.72463 7.99127 6.75249 10.7652 8.99891 4.3855 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 4.93984 7.33483 6.13061 7.95112 9.86868 11.9339 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 4.93984 7.33483 6.13061 4.03388 6.83528 10.9057 numMergedOcc 0
14 mol 198 unq 0 iso 0 dist 5.80867 7.48253 4.27652 6.36333 6.77156 10.6266 numMergedOcc 0
15 mol 198 unq 1 iso 0 dist 5.80867 7.48253 4.27652 3.69483 7.97894 10.0094 numMergedOcc 0
16 mol 198 unq 2 iso 0 dist 5.80867 7.48253 4.27652 9.0575 8.08471 7.38825 numMergedOcc 0
17 mol 198 unq 3 iso 0 dist 9.4363 6.13687 4.27652 13.9439 6.77156 10.6266 numMergedOcc 0
18 mol 198 unq 4 iso 0 dist 9.4363 6.13687 4.27652 11.1303 7.97894 10.0094 numMergedOcc 0
19 mol 198 unq 5 iso 0 dist 9.4363 6.13687 4.27652 5.89703 8.08471 7.38825 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 6.32652 7.8518 8.62057 5.43925 7.16758 12.8048 numMergedOcc 0
21 mol 213 unq 0 iso 0 dist 6.82185 7.86605 4.71943 7.38644 8.82761 8.24178 numMergedOcc 0
22 mol 213 unq 1 iso 0 dist 6.82881 7.86605 3.62097 7.85961 9.09354 7.93317 numMergedOcc 0
23 mol 213 unq 2 iso 0 dist 6.82881 7.86605 3.62097 7.38644 4.66576 8.24178 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 5.52981 8.5458 9.81852 8.95992 6.1896 15.6688 numMergedOcc 0
25 mol 218 unq 1 iso 0 dist 5.52981 8.5458 9.81852 6.50485 6.09255 13.2445 numMergedOcc 0
