0 mol 10 unq 0 iso 0 dist 9.75001 6.68744 3.25792 5.30796 8.6136 6.50154 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.06457 6.68744 4.68389 5.30796 6.02154 6.50154 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 7.61139 8.38129 4.7579 5.48326 5.9809 8.19827 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 6.54552 8.38129 3.21365 5.48326 5.83917 8.19827 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.21084 8.00784 5.2495 4.93779 10.9931 7.84204 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.07969 7.87476 11.0434 5.90067 13.1369 8.92898 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 9.61448 7.87476 12.4168 5.90067 12.4933 8.92898 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 5.9443 9.27633 5.06277 6.64721 5.28732 6.1847 numMergedOcc 0
8 mol 88 unq 1 iso 0 dist 9.16708 9.27633 8.77344 6.64721 10.3032 6.1847 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 9.88678 9.79115 6.99182 14.8266 10.6092 7.92317 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 4.33805 9.80185 13.0092 10.3678 14.1371 6.50336 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 8.18029 7.06868 5.46446 10.1284 11.3848 9.77656 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 9.432 8.33309 4.64981 13.0843 9.07839 5.69634 numMergedOcc 0
13 mol 234 unq 1 iso 0 dist 9.432 8.33309 4.64981 11.9483 11.8902 7.91374 numMergedOcc 0
14 mol 234 unq 2 iso 0 dist 9.432 8.33309 4.64981 11.0142 9.68621 7.35086 numMergedOcc 0
15 mol 234 unq 3 iso 0 dist 9.432 8.33309 4.64981 6.7061 10.7619 6.81195 numMergedOcc 0
16 mol 234 unq 4 iso 0 dist 9.00657 9.8226 4.70248 6.14528 6.96257 5.69634 numMergedOcc 0
17 mol 234 unq 5 iso 0 dist 9.00657 9.8226 4.70248 11.1481 9.73255 7.91374 numMergedOcc 0
18 mol 234 unq 6 iso 0 dist 9.00657 9.8226 4.70248 11.0167 6.86569 7.35086 numMergedOcc 0
19 mol 234 unq 7 iso 0 dist 9.00657 9.8226 4.70248 15.0842 10.9508 6.81195 numMergedOcc 0
20 mol 234 unq 8 iso 0 dist 7.87591 9.2653 4.70248 5.43106 6.96257 5.69634 numMergedOcc 0
21 mol 234 unq 9 iso 0 dist 7.87591 9.2653 4.70248 6.41546 9.73255 7.91374 numMergedOcc 0
22 mol 234 unq 10 iso 0 dist 7.87591 9.2653 4.70248 4.69096 6.86569 7.35086 numMergedOcc 0
23 mol 234 unq 11 iso 0 dist 7.87591 9.2653 4.70248 12.788 10.9508 6.81195 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 8.18813 9.48076 17.1919 8.46112 16.0632 8.13595 numMergedOcc 0
25 mol 283 unq 0 iso 0 dist 4.86946 7.15322 3.34167 7.35639 8.51504 9.66832 numMergedOcc 0
26 mol 283 unq 1 iso 0 dist 9.60873 8.91437 3.12129 10.4634 9.60574 7.83424 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 7.02131 7.89784 7.72653 7.32101 9.24197 3.93401 numMergedOcc 0
28 mol 292 unq 1 iso 0 dist 6.79765 7.89784 5.36842 7.32101 6.1905 3.93401 numMergedOcc 0
29 mol 292 unq 2 iso 0 dist 6.13272 7.89784 3.08474 7.32101 5.84792 3.93401 numMergedOcc 0
30 mol 292 unq 3 iso 0 dist 7.02679 7.89784 6.12546 7.32101 8.73515 3.93401 numMergedOcc 0
31 mol 292 unq 4 iso 0 dist 9.08889 7.89784 14.4257 7.32101 15.6627 3.93401 numMergedOcc 0
