0 mol 18 unq 0 iso 0 dist 8.24798 4.49033 8.95294 11.7139 9.9807 8.52106 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 8.24798 4.49033 8.95294 9.38772 7.30649 6.32451 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 8.02079 4.49033 7.19022 11.7139 10.4866 8.52106 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 8.02079 4.49033 7.19022 9.38772 5.31135 6.32451 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 8.66843 6.13812 7.62709 11.5838 8.60899 9.20119 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 8.34361 8.98505 8.41365 5.97635 5.65405 5.02241 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 5.68841 5.85924 7.37607 10.7681 10.6897 6.71911 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 7.75769 9.33131 7.37607 14.2522 10.6897 6.71911 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.03472 12.8333 6.58062 15.5748 11.1785 5.81965 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 9.03472 12.8333 6.58062 12.2317 10.9352 7.06013 numMergedOcc 0
10 mol 92 unq 2 iso 0 dist 9.03472 12.8333 6.58062 17.5329 10.8489 9.70512 numMergedOcc 0
11 mol 92 unq 3 iso 0 dist 9.40274 14.5544 6.58062 17.5033 11.1785 5.81965 numMergedOcc 0
12 mol 92 unq 4 iso 0 dist 9.40274 14.5544 6.58062 14.8214 10.9352 7.06013 numMergedOcc 0
13 mol 92 unq 5 iso 0 dist 9.40274 14.5544 6.58062 17.6802 10.8489 9.70512 numMergedOcc 0
14 mol 99 unq 0 iso 0 dist 7.09617 11.0363 8.86001 16.5827 12.0573 7.72108 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 5.87592 5.46352 8.77794 4.98864 5.19652 6.99777 numMergedOcc 0
16 mol 115 unq 1 iso 0 dist 8.37388 10.3995 8.77794 7.95871 5.19652 6.99777 numMergedOcc 0
17 mol 130 unq 0 iso 0 dist 4.69926 4.9574 6.16039 8.83115 5.26656 6.79146 numMergedOcc 0
18 mol 130 unq 1 iso 0 dist 4.69926 4.9574 6.16039 11.9024 10.6181 7.66168 numMergedOcc 0
19 mol 130 unq 2 iso 0 dist 4.69926 4.9574 6.16039 10.9469 9.86628 6.89257 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 9.99964 4.24915 7.88787 12.9138 10.2898 9.6668 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 6.93144 4.20499 7.88787 12.2786 10.2898 9.6668 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 7.04782 6.39513 7.88787 10.498 10.2898 9.6668 numMergedOcc 0
23 mol 181 unq 3 iso 0 dist 9.14877 10.9006 9.7281 9.84952 7.07865 7.37327 numMergedOcc 0
24 mol 232 unq 0 iso 0 dist 8.21479 6.17401 8.94854 7.70279 8.14537 7.07392 numMergedOcc 0
25 mol 232 unq 1 iso 0 dist 8.21479 6.17401 8.94854 12.1893 12.1805 9.62952 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 8.75001 11.9879 5.72415 10.6346 6.53984 6.91569 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 6.75599 5.98329 5.72415 11.7348 6.53984 6.91569 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 7.32196 4.81145 6.19514 9.32451 6.13639 6.05141 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 7.32196 4.81145 6.19514 11.5933 5.59848 8.09066 numMergedOcc 0
30 mol 238 unq 4 iso 0 dist 7.32196 4.81145 6.19514 10.7555 7.17967 7.2766 numMergedOcc 0
31 mol 247 unq 0 iso 0 dist 7.85081 4.32191 9.88695 10.5086 14.0109 6.6838 numMergedOcc 0
32 mol 253 unq 0 iso 0 dist 8.11437 8.75798 6.52138 7.15815 7.07333 7.19465 numMergedOcc 0
33 mol 257 unq 0 iso 0 dist 9.27027 7.37187 7.48361 7.82899 6.64096 7.14834 numMergedOcc 0
34 mol 257 unq 1 iso 0 dist 7.87058 7.91645 7.48361 12.5188 6.64096 7.14834 numMergedOcc 0
35 mol 274 unq 0 iso 0 dist 9.04647 6.93865 9.89613 9.65265 5.56999 6.50589 numMergedOcc 0
