0 mol 11 unq 0 iso 0 dist 8.55448 5.64982 6.89666 5.40479 4.61088 4.73237 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 7.7417 7.52123 5.41493 10.8352 6.19529 5.09229 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.66233 14.5556 5.97635 12.4716 9.5589 10.7219 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 8.66233 14.5556 5.97635 12.3075 6.83299 6.76462 numMergedOcc 0
4 mol 54 unq 2 iso 0 dist 8.66233 14.5556 5.97635 6.92468 8.10861 13.2619 numMergedOcc 0
5 mol 54 unq 3 iso 0 dist 5.88766 9.99915 5.97635 9.50681 9.5589 10.7219 numMergedOcc 0
6 mol 54 unq 4 iso 0 dist 5.88766 9.99915 5.97635 9.84851 6.83299 6.76462 numMergedOcc 0
7 mol 54 unq 5 iso 0 dist 5.88766 9.99915 5.97635 10.0995 8.10861 13.2619 numMergedOcc 0
8 mol 59 unq 0 iso 0 dist 8.3906 12.2156 6.65344 10.4426 6.85766 5.29688 numMergedOcc 0
9 mol 59 unq 1 iso 0 dist 8.3906 12.2156 6.65344 7.8601 7.71095 13.1729 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 7.91249 5.67998 5.9747 5.04286 5.08437 4.75138 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 7.91249 5.67998 5.9747 13.8365 6.48948 10.4417 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 7.91249 5.67998 5.9747 10.4243 6.10456 11.3628 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 7.91249 7.32948 4.50572 5.04286 5.08437 6.88489 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 7.91249 7.32948 4.50572 13.8365 6.48948 9.63267 numMergedOcc 0
15 mol 98 unq 5 iso 0 dist 7.91249 7.32948 4.50572 10.4243 6.10456 9.82583 numMergedOcc 0
16 mol 98 unq 6 iso 0 dist 7.94919 13.2802 5.9747 10.5282 5.08437 4.75138 numMergedOcc 0
17 mol 98 unq 7 iso 0 dist 7.94919 13.2802 5.9747 5.5392 6.48948 10.4417 numMergedOcc 0
18 mol 98 unq 8 iso 0 dist 7.94919 13.2802 5.9747 6.5508 6.10456 11.3628 numMergedOcc 0
19 mol 98 unq 9 iso 0 dist 7.94919 12.2834 4.50572 10.5282 5.08437 6.88489 numMergedOcc 0
20 mol 98 unq 10 iso 0 dist 7.94919 12.2834 4.50572 5.5392 6.48948 9.63267 numMergedOcc 0
21 mol 98 unq 11 iso 0 dist 7.94919 12.2834 4.50572 6.5508 6.10456 9.82583 numMergedOcc 0
22 mol 120 unq 0 iso 0 dist 6.68587 7.66137 7.04864 7.18082 8.75408 4.5543 numMergedOcc 0
23 mol 120 unq 1 iso 0 dist 6.68587 7.66137 7.04864 8.16257 6.44653 6.81949 numMergedOcc 0
24 mol 127 unq 0 iso 0 dist 4.84594 6.26588 9.42513 4.97123 9.30299 8.60326 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 9.36119 5.81751 6.42725 8.13646 5.30224 8.70769 numMergedOcc 0
26 mol 264 unq 0 iso 0 dist 7.62761 6.08753 8.19504 8.12266 6.24356 3.93713 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 7.22413 6.85744 9.64596 6.54153 8.48753 5.26991 numMergedOcc 0
28 mol 273 unq 0 iso 0 dist 9.54195 11.5561 8.57501 6.22293 6.92774 6.9795 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 7.144 7.39478 9.29635 6.7906 9.7748 10.8075 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 7.15 5.81536 7.74162 10.3626 9.70696 9.5773 numMergedOcc 0
