0 mol 7 unq 0 iso 0 dist 8.33249 9.26914 5.70161 5.47645 5.77374 9.8603 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.34604 9.26914 4.57188 5.47645 8.57437 9.8603 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 4.54652 7.54869 11.9881 5.41984 5.01162 11.0361 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 4.54652 6.29729 10.3564 5.41984 5.01162 11.4465 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 6.5121 7.40411 11.1307 4.65487 9.14092 11.5255 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 8.88571 6.97123 5.4671 5.15272 9.82315 10.5781 numMergedOcc 0
6 mol 61 unq 1 iso 0 dist 8.88571 9.532 10.1513 5.15272 9.82315 12.4244 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 7.76963 9.19402 5.31439 6.03473 9.06225 7.47794 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 9.64651 9.35711 9.01856 11.0512 6.70591 12.3607 numMergedOcc 0
9 mol 110 unq 1 iso 0 dist 9.64651 9.35711 9.01856 7.12329 5.43052 8.181 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 8.64606 5.7191 5.90364 10.581 5.82034 10.7523 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 8.64606 5.7191 5.90364 11.7424 6.56854 11.2617 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 9.71675 9.24777 10.913 6.68028 6.50727 13.2177 numMergedOcc 0
13 mol 197 unq 1 iso 0 dist 9.71675 9.24777 10.913 4.58651 7.84826 10.9337 numMergedOcc 0
14 mol 197 unq 2 iso 0 dist 8.67145 9.24777 8.69245 8.64161 5.79753 8.3337 numMergedOcc 0
15 mol 197 unq 3 iso 0 dist 8.67145 9.24777 8.69245 5.68443 7.56537 12.045 numMergedOcc 0
16 mol 199 unq 0 iso 0 dist 7.28311 5.45511 6.29819 4.91787 8.22146 8.30443 numMergedOcc 0
17 mol 199 unq 1 iso 0 dist 7.28311 8.84275 9.78884 4.91787 8.22146 12.5848 numMergedOcc 0
18 mol 199 unq 2 iso 0 dist 6.33787 5.45511 4.26752 4.91787 7.16849 8.30443 numMergedOcc 0
19 mol 199 unq 3 iso 0 dist 6.33787 8.84275 7.44626 4.91787 7.16849 12.5848 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 8.73109 7.27446 15.4199 5.20326 8.22353 11.5176 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 9.81682 8.8437 9.40662 7.50444 6.97456 12.9874 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 6.54658 9.13171 5.25596 4.1826 9.86356 10.6802 numMergedOcc 0
23 mol 294 unq 1 iso 0 dist 6.54658 8.84627 5.28447 4.1826 9.86356 10.4125 numMergedOcc 0
24 mol 294 unq 2 iso 0 dist 9.35351 9.13171 9.87129 4.1826 6.42303 10.6802 numMergedOcc 0
25 mol 294 unq 3 iso 0 dist 9.35351 8.84627 10.5605 4.1826 6.42303 10.4125 numMergedOcc 0
