0 mol 11 unq 0 iso 0 dist 8.73067 9.58844 6.859 4.79838 6.76736 9.89425 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 8.19695 4.01494 6.41656 7.40236 3.73148 5.72005 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 7.02548 4.01494 8.54034 7.40236 6.08459 5.72005 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 6.42834 9.95354 6.21128 13.0533 6.67385 7.31718 numMergedOcc 0
4 mol 41 unq 1 iso 0 dist 6.42834 9.95354 6.21128 15.3941 10.8632 5.47447 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 9.63599 4.1859 9.77084 9.11491 5.84075 9.04293 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 9.63599 8.68431 6.5551 9.11491 5.84075 4.78333 numMergedOcc 0
7 mol 79 unq 2 iso 0 dist 9.63599 8.68431 6.5551 12.3393 5.41884 4.74254 numMergedOcc 0
8 mol 79 unq 3 iso 0 dist 7.87237 5.72646 9.09458 7.90338 5.25584 8.18375 numMergedOcc 0
9 mol 79 unq 4 iso 0 dist 8.01743 5.95598 9.77084 8.90324 5.84075 9.04293 numMergedOcc 0
10 mol 79 unq 5 iso 0 dist 8.01743 4.47084 6.5551 8.90324 5.84075 4.78333 numMergedOcc 0
11 mol 79 unq 6 iso 0 dist 8.01743 4.47084 6.5551 7.15907 5.41884 4.74254 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 6.05495 7.2898 5.05893 5.61151 5.22259 4.29937 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 6.05495 7.2898 5.05893 6.54289 7.66499 5.37869 numMergedOcc 0
14 mol 85 unq 2 iso 0 dist 6.05495 4.13305 5.71866 5.61151 5.22259 3.65628 numMergedOcc 0
15 mol 85 unq 3 iso 0 dist 6.05495 4.13305 5.71866 6.54289 7.66499 4.05415 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 6.93279 5.58312 7.83568 10.6429 14.5488 6.76852 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 5.52683 6.37052 7.58337 11.6867 10.3222 5.95801 numMergedOcc 0
18 mol 141 unq 1 iso 0 dist 5.52683 6.37052 7.58337 15.1155 17.5034 9.92715 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 7.69296 6.2381 5.31416 8.3107 6.28944 9.59928 numMergedOcc 0
20 mol 214 unq 1 iso 0 dist 7.69296 9.8806 5.44533 8.3107 6.28944 7.70062 numMergedOcc 0
21 mol 214 unq 2 iso 0 dist 7.69296 9.8806 5.44533 10.9638 7.23583 7.66702 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 7.48235 4.52322 7.67837 13.0169 10.7788 9.67239 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 6.8972 5.77779 9.38222 11.8274 10.2578 9.06947 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 5.7131 6.87619 8.6233 3.93401 4.30125 9.21469 numMergedOcc 0
