0 mol 27 unq 0 iso 0 dist 5.66743 9.49066 9.52474 15.7694 13.3658 8.8018 numMergedOcc 0
1 mol 27 unq 1 iso 0 dist 7.42669 4.91484 9.52474 9.10646 13.3658 8.8018 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.2746 4.47138 7.56205 7.9399 6.71999 9.854 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 9.55838 9.96691 6.36086 14.2631 5.2359 7.09757 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 5.37302 14.0364 9.66219 14.8653 12.3067 5.94552 numMergedOcc 0
5 mol 113 unq 1 iso 0 dist 9.66068 16.3524 8.8822 19.3443 13.1665 5.94552 numMergedOcc 0
6 mol 113 unq 2 iso 0 dist 8.03783 16.3524 9.66219 19.3443 12.3067 5.94552 numMergedOcc 0
7 mol 113 unq 3 iso 0 dist 8.47541 12.1308 9.66219 14.7453 12.3067 5.94552 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.34823 5.3154 6.73586 6.29634 6.65893 6.16081 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.04845 13.7612 5.87634 6.58803 5.21958 8.75049 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 7.94325 12.9605 5.87634 9.96967 5.21958 8.75049 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 6.72323 4.64588 5.87634 6.31523 5.21958 8.75049 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 9.14629 7.91498 9.67741 10.6495 9.40319 5.72735 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 8.15381 5.70669 8.07687 6.38964 6.97126 7.03546 numMergedOcc 0
14 mol 219 unq 0 iso 0 dist 7.13099 5.0241 7.59632 8.15287 10.8057 7.68645 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 5.89818 4.82768 7.67576 9.40044 5.5933 8.36659 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 5.89818 4.82768 7.67576 13.6493 13.2849 9.18913 numMergedOcc 0
17 mol 222 unq 2 iso 0 dist 9.32543 4.82768 9.82371 9.40044 10.9135 8.36659 numMergedOcc 0
18 mol 222 unq 3 iso 0 dist 9.32543 4.82768 9.82371 13.6493 14.5433 9.18913 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 9.11072 9.85454 9.85289 14.4613 10.4158 8.98154 numMergedOcc 0
20 mol 274 unq 1 iso 0 dist 9.02071 5.9882 9.85289 13.3406 10.4158 8.98154 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 8.42076 8.60619 6.89451 12.8164 5.41757 9.29241 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 8.42076 8.60619 6.89451 12.8164 5.41757 9.29241 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 8.42076 8.60619 6.89451 12.8164 5.41757 9.29241 numMergedOcc 0
