0 mol 20 unq 0 iso 0 dist 6.81416 7.5037 9.47968 6.98731 8.72023 12.6153 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.15652 10.9024 8.70141 8.23069 4.93188 13.2653 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.15652 10.9024 8.70141 8.59466 9.24958 5.80023 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.44893 10.7171 8.70141 9.67461 4.93188 13.2653 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.44893 10.7171 8.70141 14.0586 9.24958 5.80023 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.8533 7.54726 6.73259 10.1933 5.69955 4.09495 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.8533 7.54726 6.73259 11.9181 8.6385 8.18809 numMergedOcc 0
7 mol 26 unq 2 iso 0 dist 8.8533 15.6533 8.60352 10.1933 5.69955 8.26353 numMergedOcc 0
8 mol 26 unq 3 iso 0 dist 8.8533 15.6533 8.60352 11.9181 8.6385 7.06347 numMergedOcc 0
9 mol 26 unq 4 iso 0 dist 6.87744 12.5131 6.73259 10.4881 5.69955 4.09495 numMergedOcc 0
10 mol 26 unq 5 iso 0 dist 6.87744 12.5131 6.73259 10.4441 8.6385 8.18809 numMergedOcc 0
11 mol 26 unq 6 iso 0 dist 6.87744 7.40006 8.60352 10.4881 5.69955 8.26353 numMergedOcc 0
12 mol 26 unq 7 iso 0 dist 6.87744 7.40006 8.60352 10.4441 8.6385 7.06347 numMergedOcc 0
13 mol 26 unq 8 iso 0 dist 7.2612 11.9212 9.46609 5.2549 8.44506 13.1626 numMergedOcc 0
14 mol 62 unq 0 iso 0 dist 7.05867 6.99148 7.34678 5.28824 9.46994 4.16095 numMergedOcc 0
15 mol 71 unq 0 iso 0 dist 9.62428 5.07949 7.23173 5.27838 7.77916 4.93292 numMergedOcc 0
16 mol 114 unq 0 iso 0 dist 5.36473 4.73128 5.82501 9.04668 9.7918 7.6321 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 9.08064 9.8421 6.0733 8.14279 8.56003 4.58263 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 9.33359 9.48296 8.38439 12.8358 8.50331 4.15973 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 8.74485 6.94884 8.81373 6.80725 8.67805 6.06308 numMergedOcc 0
20 mol 240 unq 0 iso 0 dist 5.46783 8.79048 8.44671 14.5429 9.47583 15.9853 numMergedOcc 0
21 mol 240 unq 1 iso 0 dist 5.46783 8.79048 8.44671 13.8996 8.44909 13.1893 numMergedOcc 0
22 mol 252 unq 0 iso 0 dist 8.62351 14.0369 9.81593 6.79111 8.47784 8.32163 numMergedOcc 0
23 mol 252 unq 1 iso 0 dist 8.62351 14.0369 9.81593 14.2609 8.66469 10.6815 numMergedOcc 0
24 mol 252 unq 2 iso 0 dist 8.62351 13.2459 9.78248 6.79111 8.47784 16.5062 numMergedOcc 0
25 mol 252 unq 3 iso 0 dist 8.62351 13.2459 9.78248 14.2609 8.66469 9.67333 numMergedOcc 0
26 mol 252 unq 4 iso 0 dist 9.44744 7.47327 5.22349 11.8815 6.11473 8.32163 numMergedOcc 0
27 mol 252 unq 5 iso 0 dist 6.94319 7.47327 9.81593 11.8815 8.47784 8.32163 numMergedOcc 0
28 mol 252 unq 6 iso 0 dist 6.94319 7.47327 9.81593 5.29359 8.66469 10.6815 numMergedOcc 0
29 mol 252 unq 7 iso 0 dist 6.94319 12.2701 9.78248 11.8815 8.47784 16.5062 numMergedOcc 0
30 mol 252 unq 8 iso 0 dist 6.94319 12.2701 9.78248 5.29359 8.66469 9.67333 numMergedOcc 0
31 mol 258 unq 0 iso 0 dist 8.43941 5.17102 8.15795 9.88911 9.53063 12.227 numMergedOcc 0
32 mol 294 unq 0 iso 0 dist 5.78275 14.2497 9.2542 9.13951 7.91611 11.198 numMergedOcc 0
