0 mol 38 unq 0 iso 0 dist 9.23576 9.18985 11.3707 4.57886 7.26639 10.1111 numMergedOcc 0
1 mol 60 unq 0 iso 0 dist 8.82095 9.34193 9.49968 7.32774 7.57295 6.63448 numMergedOcc 0
2 mol 60 unq 1 iso 0 dist 6.27749 9.34193 5.32257 4.44758 9.95132 11.2466 numMergedOcc 0
3 mol 60 unq 2 iso 0 dist 6.27749 9.34193 5.32257 7.32774 7.48086 6.63448 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.514 7.2131 8.55834 12.7532 8.3773 13.673 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 9.514 7.44343 9.50382 12.7532 8.3773 9.92987 numMergedOcc 0
6 mol 108 unq 0 iso 0 dist 7.29462 6.80069 10.1805 11.975 7.93045 17.1442 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 6.31633 9.10677 7.20706 6.54844 9.77497 13.7062 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 7.21115 9.10677 5.35728 7.53568 9.89083 14.0071 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.53368 5.58734 6.36778 6.14609 9.77575 6.18678 numMergedOcc 0
10 mol 127 unq 0 iso 0 dist 8.40046 8.70738 12.7065 12.1959 6.08673 18.3909 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.4473 5.80404 5.81428 12.9426 7.22643 11.9279 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.43406 6.66608 5.48529 5.71744 5.05973 5.99437 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 7.86625 9.68323 7.68794 4.82437 9.56028 13.3817 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 7.66381 9.53805 8.14815 6.01218 7.2793 11.554 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 7.66381 9.53805 8.14815 5.27656 9.51091 13.4074 numMergedOcc 0
16 mol 186 unq 2 iso 0 dist 7.66381 9.53805 8.14815 13.9441 7.85184 15.4852 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 8.43584 6.05667 11.6232 14.6356 6.49765 18.0562 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 6.97859 6.69623 10.4747 5.84459 9.21377 11.0686 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 8.39425 9.4707 4.82315 4.7404 9.20104 10.5993 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 8.39425 9.4707 4.82315 5.11711 9.58404 8.24649 numMergedOcc 0
21 mol 224 unq 0 iso 0 dist 9.75313 6.48885 10.7174 3.56689 8.08349 5.05368 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 6.77279 9.69025 8.41846 9.90573 9.07743 14.6679 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 9.58006 9.69025 8.81835 12.7528 9.63573 11.547 numMergedOcc 0
24 mol 259 unq 2 iso 0 dist 9.58006 9.69025 8.81835 9.90573 7.66153 14.6679 numMergedOcc 0
25 mol 274 unq 0 iso 0 dist 8.66451 9.02661 6.70925 16.784 9.30212 10.0206 numMergedOcc 0
26 mol 274 unq 1 iso 0 dist 8.66451 9.02661 6.70925 4.89003 6.4611 8.60027 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 9.02914 5.92532 4.37645 13.3706 5.46926 9.26157 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 9.02914 5.92532 4.37645 12.1739 5.13913 9.11117 numMergedOcc 0
29 mol 277 unq 2 iso 0 dist 6.90434 5.92532 7.70529 8.51268 9.35539 12.9467 numMergedOcc 0
30 mol 277 unq 3 iso 0 dist 6.90434 5.92532 7.70529 13.3706 8.9682 9.26157 numMergedOcc 0
31 mol 277 unq 4 iso 0 dist 6.90434 5.92532 7.70529 12.1739 6.92711 9.11117 numMergedOcc 0
32 mol 277 unq 5 iso 0 dist 9.98528 9.55366 12.6688 19.5312 9.57499 20.5753 numMergedOcc 0
33 mol 285 unq 0 iso 0 dist 8.71213 8.7964 10.4903 13.9922 7.80862 17.8196 numMergedOcc 0
34 mol 285 unq 1 iso 0 dist 8.71213 7.24072 11.2696 13.9922 7.80862 18.6089 numMergedOcc 0
