0 mol 11 unq 0 iso 0 dist 9.97185 6.56346 6.79478 9.91417 4.13124 8.01262 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.97185 6.56346 6.79478 9.95699 13.0674 6.58046 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 8.90417 8.69179 8.0614 10.234 8.33013 5.25027 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 8.90417 8.69179 8.0614 12.7549 9.53139 4.37025 numMergedOcc 0
4 mol 101 unq 0 iso 0 dist 5.58941 5.81947 8.77773 9.26699 9.58969 9.23765 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 6.00241 13.0204 9.01767 14.2 8.94532 5.54256 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 5.74521 7.79117 9.93703 10.2109 8.99475 7.60162 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 8.93408 10.7949 9.18866 11.9707 6.99467 6.73617 numMergedOcc 0
8 mol 147 unq 1 iso 0 dist 8.93408 10.7949 9.18866 11.4766 4.53687 9.03544 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 8.41938 10.6678 9.74498 9.3776 6.37913 7.55419 numMergedOcc 0
10 mol 152 unq 1 iso 0 dist 6.53428 5.29694 8.89982 7.71959 4.19899 7.55934 numMergedOcc 0
11 mol 232 unq 0 iso 0 dist 7.38809 9.36045 8.68464 10.4181 3.79439 8.60731 numMergedOcc 0
12 mol 257 unq 0 iso 0 dist 9.77089 10.3792 5.36776 18.7713 12.8843 9.6834 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 8.94629 6.30874 5.81927 11.4378 4.87461 7.12221 numMergedOcc 0
14 mol 258 unq 1 iso 0 dist 8.94629 6.30874 5.81927 8.95095 9.93118 5.4557 numMergedOcc 0
15 mol 265 unq 0 iso 0 dist 5.98977 5.26386 8.1498 10.8963 8.3919 9.28128 numMergedOcc 0
16 mol 285 unq 0 iso 0 dist 9.0062 5.23192 8.71213 8.88717 3.97296 6.71946 numMergedOcc 0
17 mol 285 unq 1 iso 0 dist 9.0062 5.23192 8.71213 13.2786 11.6681 8.28061 numMergedOcc 0
18 mol 285 unq 2 iso 0 dist 9.0062 5.23192 8.71213 10.1917 10.6606 5.03601 numMergedOcc 0
19 mol 285 unq 3 iso 0 dist 8.72607 9.00041 8.71213 9.84651 3.97296 6.71946 numMergedOcc 0
20 mol 285 unq 4 iso 0 dist 8.72607 9.00041 8.71213 16.5095 11.6681 8.28061 numMergedOcc 0
21 mol 285 unq 5 iso 0 dist 8.72607 9.00041 8.71213 13.5431 10.6606 5.03601 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 6.20852 6.05371 6.47832 10.1507 4.99494 7.56669 numMergedOcc 0
