0 mol 24 unq 0 iso 0 dist 8.95376 8.52725 6.01284 14.5246 7.70779 9.78903 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.52839 12.7555 7.96195 13.9169 7.12394 5.22014 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 7.76666 3.79852 7.4515 9.22609 12.0171 8.53833 numMergedOcc 0
3 mol 63 unq 1 iso 0 dist 7.76666 3.79852 7.4515 11.391 4.84866 9.6401 numMergedOcc 0
4 mol 89 unq 0 iso 0 dist 7.485 5.72671 6.65534 11.9488 9.1427 7.06277 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.53164 8.96364 7.0561 13.4231 10.0556 6.13521 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 7.46327 8.99253 7.8435 5.27541 3.74136 9.43355 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 7.46327 3.78587 5.99269 5.27541 3.74136 5.64141 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 7.46327 10.5386 5.71763 5.27541 3.74136 5.46186 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.70685 9.97278 7.27506 16.4671 9.2594 9.77082 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.70685 9.97278 7.27506 6.4081 6.85756 8.0675 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 9.60646 10.7996 9.43989 14.1641 5.78019 8.73613 numMergedOcc 0
12 mol 178 unq 0 iso 0 dist 8.56251 4.00111 8.25282 7.55683 6.72936 5.4647 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 6.78113 3.85894 7.88014 7.37431 6.38456 7.75041 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.67802 11.7817 7.04815 5.52744 7.74227 9.22792 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 9.67802 5.74741 6.07389 5.52744 7.74227 5.00402 numMergedOcc 0
16 mol 186 unq 2 iso 0 dist 9.18314 13.8203 7.04815 15.509 7.74227 9.22792 numMergedOcc 0
17 mol 186 unq 3 iso 0 dist 9.18314 12.4955 6.07389 15.509 7.74227 5.00402 numMergedOcc 0
18 mol 196 unq 0 iso 0 dist 5.89229 6.95386 6.25813 5.6789 3.93821 9.03626 numMergedOcc 0
19 mol 212 unq 0 iso 0 dist 6.73307 8.99365 5.50658 12.2714 6.12126 5.10392 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 8.31175 7.20921 5.8304 10.5019 4.81143 5.35326 numMergedOcc 0
