0 mol 11 unq 0 iso 0 dist 9.76233 9.12768 5.47299 7.86632 9.89425 12.9682 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 7.52145 5.64731 7.72377 12.2822 8.78511 9.9172 numMergedOcc 0
2 mol 32 unq 1 iso 0 dist 8.35776 12.3204 7.72377 4.64437 8.78511 9.9172 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 7.12713 4.50032 7.44805 6.51519 5.4713 3.66253 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 4.74574 7.40375 8.988 4.80894 6.23509 4.45758 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 8.1717 10.5572 8.96898 8.91835 9.19512 5.91118 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 5.23167 4.29159 7.01397 7.42892 7.16844 11.5628 numMergedOcc 0
7 mol 62 unq 2 iso 0 dist 7.47607 7.59441 7.01397 7.36253 7.16844 11.5628 numMergedOcc 0
8 mol 67 unq 0 iso 0 dist 9.88566 4.85065 9.10001 6.00324 5.88409 3.83735 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 8.26805 4.77004 9.50939 4.05111 5.45099 6.1999 numMergedOcc 0
10 mol 81 unq 0 iso 0 dist 7.94697 4.76773 8.57764 8.57407 8.96045 4.54161 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 7.61514 9.04544 8.67342 10.6609 4.29937 7.74857 numMergedOcc 0
12 mol 85 unq 1 iso 0 dist 7.61514 9.04544 8.67342 11.2518 3.65628 10.4876 numMergedOcc 0
13 mol 85 unq 2 iso 0 dist 7.61514 9.04544 8.67342 13.5746 9.77774 18.2213 numMergedOcc 0
14 mol 85 unq 3 iso 0 dist 7.61514 4.11312 5.73739 10.6609 4.29937 9.36582 numMergedOcc 0
15 mol 85 unq 4 iso 0 dist 7.61514 4.11312 5.73739 11.2518 3.65628 8.8983 numMergedOcc 0
16 mol 85 unq 5 iso 0 dist 7.61514 4.11312 5.73739 13.5746 9.77774 11.1809 numMergedOcc 0
17 mol 85 unq 6 iso 0 dist 8.21116 9.04544 8.60062 10.6609 5.37869 7.74857 numMergedOcc 0
18 mol 85 unq 7 iso 0 dist 8.21116 9.04544 8.60062 11.2518 4.05415 10.4876 numMergedOcc 0
19 mol 85 unq 8 iso 0 dist 8.21116 9.04544 8.60062 13.5746 9.97944 18.2213 numMergedOcc 0
20 mol 85 unq 9 iso 0 dist 8.21116 4.11312 5.16225 10.6609 5.37869 9.36582 numMergedOcc 0
21 mol 85 unq 10 iso 0 dist 8.21116 4.11312 5.16225 11.2518 4.05415 8.8983 numMergedOcc 0
22 mol 85 unq 11 iso 0 dist 8.21116 4.11312 5.16225 13.5746 9.97944 11.1809 numMergedOcc 0
23 mol 169 unq 0 iso 0 dist 6.18165 12.2667 6.27378 14.017 8.6961 7.58935 numMergedOcc 0
24 mol 171 unq 0 iso 0 dist 6.80203 6.94063 8.82481 4.91613 9.68512 5.35456 numMergedOcc 0
25 mol 171 unq 1 iso 0 dist 8.00826 4.53761 8.82481 4.61696 9.68512 5.35456 numMergedOcc 0
26 mol 198 unq 0 iso 0 dist 9.55667 7.58767 7.95437 11.3881 7.04521 4.58443 numMergedOcc 0
27 mol 239 unq 0 iso 0 dist 9.76929 6.65459 4.44509 8.16343 7.97504 4.08014 numMergedOcc 0
