0 mol 25 unq 0 iso 0 dist 8.50539 6.34277 5.8503 5.55893 8.6396 5.04899 4.68147 5.77745 7.05196 6.47509 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.83402 8.46842 5.59268 13.3513 10.5993 7.57578 5.03904 8.27137 4.79873 10.2864 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 8.83402 8.46842 5.59268 13.3513 10.5993 7.57578 16.8735 13.4236 9.48085 5.18617 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 8.83402 8.46842 5.59268 14.4516 8.88413 7.17969 5.03904 8.27137 4.79873 11.4148 numMergedOcc 0
4 mol 25 unq 4 iso 0 dist 8.83402 8.46842 5.59268 14.4516 8.88413 7.17969 16.8735 13.4236 9.48085 5.68041 numMergedOcc 0
5 mol 25 unq 5 iso 0 dist 8.58806 8.50987 14.3338 6.44262 13.3292 6.03987 9.55844 17.5674 7.99919 4.77954 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 4.76012 6.1421 6.43966 7.86921 10.2333 8.54584 3.82645 8.23699 6.69691 8.26896 numMergedOcc 0
7 mol 129 unq 1 iso 0 dist 4.76012 6.1421 6.43966 7.86921 10.2333 8.54584 5.75588 6.53559 5.51197 12.1739 numMergedOcc 0
8 mol 129 unq 2 iso 0 dist 4.76012 6.1421 6.43966 7.86921 10.2333 8.54584 4.18263 7.90844 8.86944 5.63254 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 7.56833 7.49404 5.6098 7.91807 6.31125 8.40312 7.08715 9.10434 9.27976 3.98662 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 6.34149 9.45717 14.5572 4.28997 9.60921 6.82262 5.815 11.87 9.05342 4.88025 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 8.63279 9.45717 16.553 4.28997 12.4731 6.82262 5.815 14.1358 9.05342 4.88025 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 9.22999 5.07968 5.38988 4.58603 12.5997 9.41367 4.49605 12.4823 8.2123 4.49451 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 8.15743 6.94983 9.60401 5.08111 9.29752 8.27212 7.30782 12.6048 6.71524 5.10213 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 5.67249 7.17987 6.50055 14.7629 15.2381 9.45496 12.4759 12.6209 7.81215 12.4252 numMergedOcc 0
15 mol 234 unq 1 iso 0 dist 5.67249 7.17987 6.50055 13.5847 12.803 6.7625 12.4759 12.6209 7.81215 5.75498 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 5.40329 6.67907 4.32403 5.81354 9.05929 8.04248 7.15922 10.5185 8.23087 4.66414 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 5.03174 6.20796 6.12009 6.9758 10.7664 9.17653 4.66338 7.19658 8.29262 10.7813 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 7.22743 7.73693 6.12009 5.00433 10.7664 9.17653 10.3972 7.19658 8.29262 10.7813 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.84909 6.87804 8.04474 11.634 9.30668 8.2734 4.77692 5.72473 7.20674 7.8414 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 6.84909 6.87804 8.04474 11.634 9.30668 8.2734 6.38012 12.7549 8.38121 14.179 numMergedOcc 0
21 mol 292 unq 2 iso 0 dist 6.38051 6.07571 9.00118 8.66797 12.6526 8.2734 11.6413 12.9195 7.20674 7.8414 numMergedOcc 0
22 mol 292 unq 3 iso 0 dist 6.38051 6.07571 9.00118 8.66797 12.6526 8.2734 14.3549 16.2478 8.38121 14.179 numMergedOcc 0
