0 mol 1 unq 0 iso 0 dist 8.27735 8.7275 4.50502 6.03793 8.56884 5.96833 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.13365 6.77987 10.2876 10.7829 9.75144 16.7676 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.47617 7.86479 8.6477 10.7814 9.83618 13.1351 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.51543 8.18572 5.31985 8.36307 6.21982 9.4866 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 9.32453 8.25047 6.77898 12.9327 9.49449 10.9283 numMergedOcc 0
5 mol 89 unq 0 iso 0 dist 5.25504 5.65453 6.13636 4.37893 8.75946 9.8042 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.11612 6.17349 4.48636 5.39389 7.76729 10.1174 numMergedOcc 0
7 mol 115 unq 1 iso 0 dist 5.11612 9.21978 6.63111 5.39389 7.76729 8.0168 numMergedOcc 0
8 mol 115 unq 2 iso 0 dist 5.22628 9.26505 6.95773 9.16391 9.66954 10.8109 numMergedOcc 0
9 mol 115 unq 3 iso 0 dist 5.22628 9.26505 6.95773 5.26498 7.64585 7.65255 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 8.94909 7.33743 15.0115 11.1266 7.92688 16.243 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 6.76166 9.13631 11.5407 6.15672 8.94837 5.52149 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 7.2977 9.13631 5.91192 6.15672 7.77454 5.52149 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 7.81701 9.62309 4.91618 5.88778 8.19104 6.88846 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 9.25604 7.96394 14.3561 5.5355 6.88137 12.3812 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 9.25604 8.01381 9.53971 5.5355 6.88137 11.3318 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 9.09857 5.82174 3.74688 9.00192 8.31897 6.52508 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 7.94593 8.03208 5.00913 11.0605 9.31887 9.76114 numMergedOcc 0
18 mol 175 unq 1 iso 0 dist 7.94593 8.70409 5.42675 11.0605 9.31887 12.8868 numMergedOcc 0
19 mol 178 unq 0 iso 0 dist 7.14849 5.4647 6.42973 8.42124 8.96511 12.6109 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 9.50454 9.19831 4.61184 10.9336 6.93764 11.187 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 7.15963 9.19831 9.83826 9.09192 6.94688 12.6052 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 7.15963 9.19831 9.83826 12.1848 6.71012 12.7471 numMergedOcc 0
23 mol 183 unq 0 iso 0 dist 9.09322 9.3066 6.2342 6.93732 7.01383 10.9213 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 5.5581 9.04035 11.3125 4.70359 9.59333 10.1538 numMergedOcc 0
25 mol 204 unq 1 iso 0 dist 9.66975 8.73525 11.3125 4.21758 9.59333 10.1538 numMergedOcc 0
26 mol 234 unq 0 iso 0 dist 6.15754 6.39499 5.53885 4.48571 6.25105 7.36208 numMergedOcc 0
27 mol 234 unq 1 iso 0 dist 8.9413 6.39499 3.95629 6.40261 9.5707 8.27411 numMergedOcc 0
28 mol 234 unq 2 iso 0 dist 8.9413 6.39499 3.95629 4.48571 7.85175 7.36208 numMergedOcc 0
29 mol 235 unq 0 iso 0 dist 8.79626 9.20504 4.5022 12.9417 7.32211 11.7973 numMergedOcc 0
30 mol 235 unq 1 iso 0 dist 8.79626 6.15704 4.21867 12.9417 7.32211 9.85304 numMergedOcc 0
31 mol 243 unq 0 iso 0 dist 9.39147 8.8602 11.8376 11.562 8.61104 18.3836 numMergedOcc 0
