0 mol 16 unq 0 iso 0 dist 8.60935 6.32791 10.2338 11.1182 17.6591 7.65889 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.5448 8.88829 12.4304 4.35522 12.0665 7.26268 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 8.98691 6.5136 9.7565 5.9335 8.0675 9.3948 numMergedOcc 0
3 mol 95 unq 1 iso 0 dist 8.98691 6.5136 9.7565 9.88003 14.3138 9.74607 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.96016 9.48388 8.49566 4.54306 8.65429 7.78931 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 8.96016 9.48388 8.49566 10.9661 13.0419 8.7497 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 5.51129 6.1421 5.57978 3.82645 8.4375 6.69691 numMergedOcc 0
7 mol 129 unq 1 iso 0 dist 5.51129 6.1421 5.57978 5.75588 8.62413 5.51197 numMergedOcc 0
8 mol 129 unq 2 iso 0 dist 5.51129 6.1421 5.57978 4.18263 6.93102 8.86944 numMergedOcc 0
9 mol 233 unq 0 iso 0 dist 8.27116 4.94074 9.08355 7.83075 15.8895 8.51625 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 9.7451 9.09166 5.37535 17.7087 12.9409 9.08509 numMergedOcc 0
11 mol 241 unq 0 iso 0 dist 5.65753 5.40961 7.9304 4.61243 6.2767 7.95042 numMergedOcc 0
12 mol 241 unq 1 iso 0 dist 7.31224 5.57621 7.9304 6.31237 6.2767 7.95042 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 8.91236 9.89728 10.3156 13.7396 13.5375 5.85442 numMergedOcc 0
14 mol 259 unq 1 iso 0 dist 8.91236 9.89728 10.3156 15.7491 13.6039 6.95511 numMergedOcc 0
15 mol 264 unq 0 iso 0 dist 6.14231 8.43682 6.67602 4.66338 9.93738 9.19754 numMergedOcc 0
16 mol 264 unq 1 iso 0 dist 6.14231 6.20796 5.7052 4.66338 9.93738 8.29262 numMergedOcc 0
17 mol 264 unq 2 iso 0 dist 4.68488 7.73693 5.7052 10.3972 9.93738 8.29262 numMergedOcc 0
18 mol 270 unq 0 iso 0 dist 8.36659 9.02113 4.26143 4.65147 10.6783 9.31275 numMergedOcc 0
19 mol 270 unq 1 iso 0 dist 8.36659 9.02113 4.26143 7.14116 10.0439 8.56508 numMergedOcc 0
20 mol 276 unq 0 iso 0 dist 9.37008 8.63281 6.23528 7.37489 8.53037 8.6759 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 8.22261 5.22392 4.627 6.68571 10.8958 9.57499 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 8.22261 8.20217 8.52993 6.68571 10.8958 5.46926 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 8.22261 8.20217 8.52993 9.44642 12.7642 5.13913 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 5.70701 5.22392 5.07427 6.68571 10.2547 9.57499 numMergedOcc 0
25 mol 277 unq 4 iso 0 dist 5.70701 8.20217 10.2752 6.68571 10.2547 5.46926 numMergedOcc 0
26 mol 277 unq 5 iso 0 dist 5.70701 8.20217 10.2752 9.44642 13.0612 5.13913 numMergedOcc 0
