0 mol 37 unq 0 iso 0 dist 8.82649 7.86222 7.17699 11.5334 6.84337 4.36537 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.80334 4.16088 9.54797 14.2257 7.34031 12.9941 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.45484 4.09894 9.76285 13.7393 7.281 13.0328 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 8.64746 6.10515 8.4517 7.07433 9.32552 6.90629 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 6.61636 10.6348 9.94276 10.745 6.51868 6.00607 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 6.61636 10.6348 9.94276 11.3682 7.34698 12.0514 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 6.61636 6.47676 9.05357 10.745 6.51868 10.2267 numMergedOcc 0
7 mol 133 unq 3 iso 0 dist 6.61636 6.47676 9.05357 11.3682 7.34698 14.5639 numMergedOcc 0
8 mol 133 unq 4 iso 0 dist 6.61636 6.95294 5.99299 10.745 6.51868 5.59913 numMergedOcc 0
9 mol 133 unq 5 iso 0 dist 6.61636 6.95294 5.99299 11.3682 7.34698 6.27692 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 8.54318 6.40439 6.51096 11.765 9.0529 7.6506 numMergedOcc 0
11 mol 155 unq 1 iso 0 dist 8.54318 6.76022 8.73171 11.765 9.0529 6.00473 numMergedOcc 0
12 mol 157 unq 0 iso 0 dist 5.87379 7.12249 7.23499 6.39342 6.455 8.17657 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 7.33162 14.5546 9.79554 4.67407 8.41245 12.6533 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 7.33162 14.5546 9.79554 6.34062 6.64779 15.1434 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 4.57548 7.57139 7.25543 5.86546 7.02079 7.4465 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 4.57548 7.57139 7.25543 8.35939 5.88802 6.76677 numMergedOcc 0
17 mol 254 unq 0 iso 0 dist 9.84153 5.86084 6.03988 10.7426 8.94909 6.6011 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 9.44826 12.0966 8.76313 15.4791 8.92185 5.19922 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 9.44826 5.92281 7.4363 15.4791 8.92185 10.2977 numMergedOcc 0
