0 mol 26 unq 0 iso 0 dist 6.93801 8.98417 5.45023 6.61393 7.90721 6.7142 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 7.89705 9.18836 6.32189 6.02913 7.56029 10.2578 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 7.89705 6.07294 4.85777 6.02913 7.56029 6.21128 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 8.83047 8.5021 9.61785 5.86191 6.2676 10.99 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 9.16658 5.55574 12.5323 5.74753 7.4515 11.0636 numMergedOcc 0
5 mol 63 unq 1 iso 0 dist 8.94047 5.55574 9.63391 5.74753 9.76551 11.0636 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.14178 6.82707 9.43915 4.93697 5.17145 8.4701 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 6.07578 7.99438 10.3996 5.21981 8.04168 10.8539 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 6.07578 7.99438 10.3996 8.12985 5.70907 14.9591 numMergedOcc 0
9 mol 79 unq 2 iso 0 dist 6.07578 6.64915 11.2341 5.21981 8.04168 8.50427 numMergedOcc 0
10 mol 79 unq 3 iso 0 dist 6.07578 6.64915 11.2341 8.12985 5.70907 14.7047 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 5.22996 8.96747 12.0757 7.25403 7.0561 12.7637 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 7.50206 6.51968 8.06011 9.41812 9.12084 11.215 numMergedOcc 0
13 mol 128 unq 1 iso 0 dist 7.50206 7.61237 5.19611 9.41812 9.12084 12.9649 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 4.0037 9.31172 11.4153 9.37239 7.17037 10.7396 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 8.63008 8.09776 7.50057 5.39223 5.53324 9.64441 numMergedOcc 0
16 mol 194 unq 1 iso 0 dist 8.63008 8.09776 7.50057 11.8568 6.72182 9.00322 numMergedOcc 0
17 mol 194 unq 2 iso 0 dist 8.63008 5.4455 5.92931 5.39223 5.53324 4.19371 numMergedOcc 0
18 mol 194 unq 3 iso 0 dist 8.63008 5.4455 5.92931 11.8568 6.72182 11.7017 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 5.46768 9.25935 6.0634 4.79025 6.34234 6.22742 numMergedOcc 0
20 mol 195 unq 1 iso 0 dist 5.46768 9.25935 6.0634 6.01032 7.87972 13.3723 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 8.83751 6.91534 13.3917 3.28983 6.43209 8.95511 numMergedOcc 0
22 mol 239 unq 1 iso 0 dist 8.83751 8.67704 14.4176 3.28983 6.43209 11.3228 numMergedOcc 0
23 mol 239 unq 2 iso 0 dist 8.77688 6.91534 9.38172 3.28983 8.48769 8.95511 numMergedOcc 0
24 mol 239 unq 3 iso 0 dist 8.77688 8.67704 9.33091 3.28983 8.48769 11.3228 numMergedOcc 0
25 mol 250 unq 0 iso 0 dist 5.43238 9.5746 6.93529 5.17779 6.93875 10.9081 numMergedOcc 0
26 mol 250 unq 1 iso 0 dist 9.48115 8.85979 14.352 7.72649 8.43577 14.9601 numMergedOcc 0
27 mol 266 unq 0 iso 0 dist 9.98606 9.54381 8.62248 9.91008 8.20485 9.63518 numMergedOcc 0
28 mol 278 unq 0 iso 0 dist 8.04138 9.73172 13.537 13.9445 8.63072 20.2094 numMergedOcc 0
29 mol 278 unq 1 iso 0 dist 8.04138 9.73172 13.537 13.0506 7.59696 16.5137 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 8.84798 5.94449 5.89415 14.4305 5.8304 11.458 numMergedOcc 0
31 mol 279 unq 1 iso 0 dist 8.84798 5.94449 5.89415 6.08238 7.37478 8.98854 numMergedOcc 0
32 mol 279 unq 2 iso 0 dist 8.84798 8.61452 14.0491 14.4305 5.8304 19.1081 numMergedOcc 0
33 mol 279 unq 3 iso 0 dist 8.84798 8.61452 14.0491 6.08238 7.37478 13.9078 numMergedOcc 0
34 mol 279 unq 4 iso 0 dist 8.84798 7.66302 15.1378 14.4305 5.8304 19.7895 numMergedOcc 0
35 mol 279 unq 5 iso 0 dist 8.84798 7.66302 15.1378 6.08238 7.37478 9.42255 numMergedOcc 0
36 mol 279 unq 6 iso 0 dist 7.5355 9.29922 8.43508 4.91802 5.81528 7.17958 numMergedOcc 0
37 mol 284 unq 0 iso 0 dist 5.68818 4.87349 9.97867 14.1802 9.07503 18.8783 numMergedOcc 0
38 mol 284 unq 1 iso 0 dist 5.68818 4.87349 9.97867 11.9492 7.63256 16.5656 numMergedOcc 0
