0 mol 24 unq 0 iso 0 dist 6.80849 4.98987 6.11056 14.0145 9.90845 13.7241 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.47617 12.345 8.38387 17.2393 9.74445 7.67926 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.13476 10.5752 5.97635 12.423 6.59893 6.31564 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 6.13476 10.5752 5.97635 9.45804 5.59773 4.94741 numMergedOcc 0
4 mol 110 unq 0 iso 0 dist 8.1306 6.9318 9.73174 9.6516 5.25492 11.3462 numMergedOcc 0
5 mol 110 unq 1 iso 0 dist 8.1306 4.29339 9.65418 9.6516 5.25492 12.1775 numMergedOcc 0
6 mol 122 unq 0 iso 0 dist 8.054 4.79314 6.78949 5.27855 8.33083 9.13822 numMergedOcc 0
7 mol 122 unq 1 iso 0 dist 8.054 5.45124 9.40018 5.27855 8.33083 3.45209 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 9.0847 11.6766 8.07256 17.3026 9.10619 8.50267 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 7.09426 7.40628 8.03995 12.2153 7.66381 14.6683 numMergedOcc 0
10 mol 196 unq 0 iso 0 dist 7.23126 15.4605 8.79558 13.7733 6.76923 3.60144 numMergedOcc 0
11 mol 196 unq 1 iso 0 dist 7.82805 15.4921 8.79558 12.3428 6.76923 3.60144 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 8.47457 10.5366 8.46129 5.57 7.39839 9.97999 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 8.39522 5.58605 6.24928 11.1968 9.75174 9.87348 numMergedOcc 0
14 mol 253 unq 0 iso 0 dist 9.86979 9.99077 5.89502 11.834 7.7993 4.10634 numMergedOcc 0
15 mol 253 unq 1 iso 0 dist 9.86979 9.99077 5.89502 6.26583 6.10761 4.97753 numMergedOcc 0
16 mol 253 unq 2 iso 0 dist 9.86979 11.0003 7.15815 11.834 7.7993 11.0688 numMergedOcc 0
17 mol 253 unq 3 iso 0 dist 9.86979 11.0003 7.15815 6.26583 6.10761 5.23198 numMergedOcc 0
18 mol 257 unq 0 iso 0 dist 8.95261 15.2818 7.82899 13.3046 5.36776 5.95774 numMergedOcc 0
19 mol 257 unq 1 iso 0 dist 7.80336 12.1004 7.82899 11.62 5.36776 5.95774 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 5.29682 6.00285 5.90645 4.98212 6.77279 6.13878 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 7.83102 9.76011 7.04833 10.5845 8.1498 10.3384 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.64889 14.9226 9.29635 6.7593 6.90434 15.5244 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 6.70123 4.31756 9.77689 6.00086 9.98528 7.41383 numMergedOcc 0
24 mol 277 unq 2 iso 0 dist 6.70123 11.7666 8.51931 6.00086 9.98528 17.1833 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 7.63115 9.73504 7.74162 7.675 8.13489 11.6227 numMergedOcc 0
