0 mol 24 unq 0 iso 0 dist 7.84552 8.3964 3.4435 10.6642 4.87192 4.90592 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 8.57551 7.96312 5.92112 4.7474 7.43804 7.45532 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 9.32506 7.67129 5.92112 9.37609 7.43804 7.45532 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 8.31737 9.79863 12.1326 17.3467 9.05254 19.1297 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.55565 6.66506 4.10173 5.67493 9.22853 6.48232 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 7.43445 6.67326 6.65893 11.6071 8.81779 14.7366 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 6.28208 8.64019 6.93115 6.87987 9.23243 6.03352 numMergedOcc 0
7 mol 162 unq 0 iso 0 dist 9.98649 6.80226 6.49195 11.1983 9.26529 13.1581 numMergedOcc 0
8 mol 162 unq 1 iso 0 dist 9.98649 6.80226 6.49195 6.62679 6.0532 7.58035 numMergedOcc 0
9 mol 162 unq 2 iso 0 dist 7.80955 9.31025 8.06906 7.6506 6.00293 7.14263 numMergedOcc 0
10 mol 162 unq 3 iso 0 dist 6.66396 8.54006 6.76865 7.2417 6.00293 8.57005 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 4.46402 5.79029 3.64317 6.35196 6.08508 9.30573 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 7.90789 9.31172 9.00139 12.2526 9.27871 12.2109 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.49617 6.23057 3.5693 8.43505 5.96238 5.95375 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 9.49617 6.23057 3.5693 11.501 7.85966 9.17946 numMergedOcc 0
15 mol 205 unq 2 iso 0 dist 9.15508 5.63477 9.6084 6.01148 5.96238 9.90954 numMergedOcc 0
16 mol 205 unq 3 iso 0 dist 9.15508 5.63477 9.6084 8.17894 7.85966 11.2584 numMergedOcc 0
17 mol 205 unq 4 iso 0 dist 8.54088 5.63477 8.16279 6.01148 8.24405 9.90954 numMergedOcc 0
18 mol 223 unq 0 iso 0 dist 9.0935 7.24878 10.0932 6.74204 5.46783 11.5371 numMergedOcc 0
19 mol 230 unq 0 iso 0 dist 7.5725 8.85051 6.78617 5.02022 7.81987 6.34832 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 7.7033 8.51736 3.63667 11.8444 9.96989 13.3359 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 8.45942 4.87349 12.2307 13.0591 5.49079 17.2393 numMergedOcc 0
