0 mol 34 unq 0 iso 0 dist 6.17472 5.3372 6.87871 9.48195 15.1968 9.99939 7.67336 11.0775 4.30086 7.07773 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.58709 9.69698 9.74445 7.80117 5.46849 9.02471 7.90905 7.53564 5.90113 9.79386 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 7.53564 5.90113 9.74445 9.79386 5.46849 9.02471 7.90905 8.58709 9.69698 7.80117 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.02351 13.6586 9.68526 13.0161 8.0072 6.23522 14.5875 8.40844 5.33851 5.7576 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.66342 16.8585 9.68526 15.4845 8.0072 6.23522 13.6926 8.40844 5.33851 5.7576 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 7.21285 16.8585 9.72442 15.4845 9.61302 6.23522 13.6926 6.99156 5.33851 5.7576 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 9.61113 13.9809 9.01767 13.6468 8.94532 5.54256 12.0662 7.73836 5.09542 9.5434 numMergedOcc 0
7 mol 102 unq 1 iso 0 dist 7.59973 13.9809 9.80678 13.6468 6.94341 5.54256 12.0662 10.8539 5.09542 9.5434 numMergedOcc 0
8 mol 122 unq 0 iso 0 dist 9.44209 11.9943 8.33083 16.2696 12.2092 4.42563 13.3702 12.1456 7.21898 8.08737 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 8.26291 5.25879 8.54461 8.12319 4.81304 8.81797 13.7304 7.86001 10.7254 9.04366 numMergedOcc 0
10 mol 130 unq 1 iso 0 dist 8.26291 10.9365 7.83619 8.12319 4.81304 5.92733 13.7304 7.86001 5.63567 9.04366 numMergedOcc 0
11 mol 130 unq 2 iso 0 dist 7.86001 10.7254 8.54461 9.04366 4.81304 8.81797 13.7304 8.26291 5.25879 8.12319 numMergedOcc 0
12 mol 130 unq 3 iso 0 dist 7.86001 5.63567 7.83619 9.04366 4.81304 5.92733 13.7304 8.26291 10.9365 8.12319 numMergedOcc 0
13 mol 213 unq 0 iso 0 dist 8.84278 8.28789 4.58599 10.0436 5.36904 4.66576 6.97479 10.2493 10.3241 8.64187 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 7.33708 11.4953 8.68464 10.9832 3.79439 8.60731 9.5675 4.46314 5.20266 4.76819 numMergedOcc 0
15 mol 257 unq 0 iso 0 dist 5.65496 5.99362 5.36776 15.1379 12.8843 9.6834 12.1418 10.7763 6.64096 8.81508 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 8.19772 4.36105 9.59213 9.92275 13.876 8.54108 9.27793 13.8245 11.263 7.7096 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 7.59956 11.3084 9.02749 14.266 12.2201 8.12739 13.2257 14.7487 7.64772 8.90108 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 7.59956 11.3084 9.02749 16.0242 12.2802 6.09853 18.2296 15.7327 7.26296 7.70811 numMergedOcc 0
19 mol 274 unq 2 iso 0 dist 7.59956 11.3084 9.02749 16.0242 12.2802 6.09853 13.2257 14.7487 7.64772 9.98144 numMergedOcc 0
20 mol 274 unq 3 iso 0 dist 8.05503 16.897 9.02749 19.8211 12.2201 8.12739 22.3248 14.7487 7.64772 8.90108 numMergedOcc 0
21 mol 274 unq 4 iso 0 dist 8.05503 16.897 9.02749 20.1079 12.2802 6.09853 23.2581 15.7327 7.26296 7.70811 numMergedOcc 0
22 mol 274 unq 5 iso 0 dist 8.05503 16.897 9.02749 20.1079 12.2802 6.09853 22.3248 14.7487 7.64772 9.98144 numMergedOcc 0
23 mol 274 unq 6 iso 0 dist 5.59151 13.8866 9.02749 14.3673 12.2201 8.12739 18.7566 14.7487 7.64772 8.90108 numMergedOcc 0
24 mol 274 unq 7 iso 0 dist 5.59151 13.8866 9.02749 15.6735 12.2802 6.09853 20.6127 15.7327 7.26296 7.70811 numMergedOcc 0
25 mol 274 unq 8 iso 0 dist 5.59151 13.8866 9.02749 15.6735 12.2802 6.09853 18.7566 14.7487 7.64772 9.98144 numMergedOcc 0
