0 mol 1 unq 0 iso 0 dist 9.76602 5.55519 6.2936 13.4579 5.19589 8.69605 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 6.23138 7.89444 9.23947 9.82294 8.95689 5.66803 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 9.97781 8.47939 7.65069 14.7329 7.26402 7.72515 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 5.51406 6.16048 6.93893 9.63646 5.06999 8.91354 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 9.13032 7.3651 9.68619 8.75165 3.96279 6.79959 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 7.6005 16.186 9.2638 16.5838 10.5909 6.53824 numMergedOcc 0
6 mol 116 unq 1 iso 0 dist 7.6005 16.186 9.2638 12.4936 6.2875 6.61973 numMergedOcc 0
7 mol 116 unq 2 iso 0 dist 8.7583 17.5453 9.2638 19.124 10.5909 6.53824 numMergedOcc 0
8 mol 116 unq 3 iso 0 dist 8.7583 17.5453 9.2638 14.7718 6.2875 6.61973 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 5.49198 8.22726 7.50264 15.9043 13.5143 9.88178 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 9.41073 7.75436 8.40219 5.47265 5.30729 5.32865 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 9.80819 14.6035 7.46919 13.508 9.03832 8.6953 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 9.86714 7.51096 8.24581 15.2547 10.0113 8.6953 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 9.81665 14.6751 7.36989 13.5808 9.0892 8.65967 numMergedOcc 0
14 mol 150 unq 1 iso 0 dist 9.33412 7.47118 8.17805 15.1276 10.21 8.65967 numMergedOcc 0
15 mol 162 unq 0 iso 0 dist 8.63323 10.4244 8.11292 9.74749 4.05981 9.96586 numMergedOcc 0
16 mol 162 unq 1 iso 0 dist 8.63323 5.55488 8.54006 9.74749 4.05981 7.30751 numMergedOcc 0
17 mol 162 unq 2 iso 0 dist 9.76987 6.32826 8.11292 12.8189 4.05981 9.96586 numMergedOcc 0
18 mol 162 unq 3 iso 0 dist 9.76987 11.3892 8.54006 12.8189 4.05981 7.30751 numMergedOcc 0
19 mol 188 unq 0 iso 0 dist 9.99421 9.44575 6.47305 13.5626 10.2716 8.1907 numMergedOcc 0
20 mol 188 unq 1 iso 0 dist 9.37017 9.44575 6.20426 13.5626 5.01686 8.1907 numMergedOcc 0
21 mol 195 unq 0 iso 0 dist 8.80931 7.23085 9.25935 12.8447 8.71774 7.2833 numMergedOcc 0
22 mol 204 unq 0 iso 0 dist 8.62191 4.72843 9.46973 10.6489 4.29037 9.52029 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 7.4513 4.68697 7.46122 12.1871 9.36068 9.89039 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 7.4513 4.68697 7.46122 12.0906 15.6078 8.57174 numMergedOcc 0
25 mol 232 unq 0 iso 0 dist 7.83422 9.592 9.25162 13.7482 9.4234 6.77822 numMergedOcc 0
26 mol 244 unq 0 iso 0 dist 8.08939 16.7895 9.97458 22.2199 16.3 7.43391 numMergedOcc 0
27 mol 244 unq 1 iso 0 dist 8.08939 16.7895 9.97458 11.1378 4.89551 7.79787 numMergedOcc 0
28 mol 244 unq 2 iso 0 dist 7.33574 15.1633 9.97458 21.8817 16.3 7.43391 numMergedOcc 0
29 mol 244 unq 3 iso 0 dist 7.33574 15.1633 9.97458 11.909 4.89551 7.79787 numMergedOcc 0
