0 mol 56 unq 0 iso 0 dist 7.96214 9.62656 9.29791 13.6612 9.06142 18.2798 numMergedOcc 0
1 mol 56 unq 1 iso 0 dist 7.96214 9.62656 9.29791 11.9413 8.41264 15.7162 numMergedOcc 0
2 mol 56 unq 2 iso 0 dist 7.96214 6.86162 12.0466 13.6612 9.06142 19.8132 numMergedOcc 0
3 mol 56 unq 3 iso 0 dist 7.96214 6.86162 12.0466 11.9413 8.41264 17.3878 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 8.60438 7.15918 6.55381 9.63545 9.06641 12.0429 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 5.22576 9.27894 5.09341 6.39764 8.91354 9.84288 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 7.53333 7.54622 9.7845 5.2815 6.90966 11.7086 numMergedOcc 0
7 mol 132 unq 0 iso 0 dist 8.97036 9.34754 6.75336 12.389 6.94745 13.6736 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 8.66519 8.96534 16.3246 16.2743 8.72323 24.3041 numMergedOcc 0
9 mol 168 unq 1 iso 0 dist 8.66519 8.65328 17.2974 16.2743 8.72323 24.3723 numMergedOcc 0
10 mol 168 unq 2 iso 0 dist 8.66519 5.69346 7.95609 16.2743 8.72323 16.1975 numMergedOcc 0
11 mol 168 unq 3 iso 0 dist 8.35731 9.02836 16.3246 15.4709 8.72323 24.3041 numMergedOcc 0
12 mol 168 unq 4 iso 0 dist 8.35731 8.55388 7.95609 15.4709 8.72323 16.1975 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 6.73513 6.3407 6.31671 7.90201 4.81837 9.40312 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 6.73513 6.3407 6.31671 11.9426 6.43519 7.53734 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 9.02319 8.55819 16.5165 6.67297 7.11741 11.816 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 9.02319 8.55819 16.5165 7.49843 8.8113 10.0366 numMergedOcc 0
17 mol 229 unq 0 iso 0 dist 5.95601 9.69367 6.80826 4.47956 7.48693 12.6288 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 5.50553 8.34536 7.23383 11.0096 9.8165 13.69 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 9.51286 6.61768 7.90149 8.13583 9.0836 8.9221 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 9.51286 6.61768 7.90149 4.80695 9.62494 9.51145 numMergedOcc 0
21 mol 266 unq 2 iso 0 dist 8.78501 8.6959 5.85295 8.96584 9.39714 10.9977 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.60879 8.20902 5.38166 4.00063 6.66936 6.42951 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 6.92271 8.20902 6.65084 4.00063 8.15119 6.42951 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 9.38624 8.71745 6.03488 6.92318 5.83342 8.67283 numMergedOcc 0
