0 mol 16 unq 0 iso 0 dist 6.84569 9.57729 8.67719 5.66529 6.58035 5.1298 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.84569 9.57729 8.67719 6.32814 8.41862 13.18 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.70415 14.0458 9.62468 10.4362 8.76003 6.91052 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 9.70415 6.47853 5.92705 10.4362 8.76003 7.34319 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 9.37094 17.5747 9.74996 13.9612 7.04352 4.68683 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 9.37094 17.5747 9.74996 4.64762 8.1114 17.5002 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 6.09906 4.19771 8.0614 12.0756 7.87814 12.5495 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 9.84673 12.6508 9.10229 7.6114 9.94856 6.83631 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 9.62866 7.08407 8.64783 11.5609 6.73814 7.19662 numMergedOcc 0
9 mol 117 unq 0 iso 0 dist 7.0318 10.7285 7.70533 5.70073 6.62561 12.4058 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 8.99949 7.31861 8.97145 9.45501 6.91348 10.4276 numMergedOcc 0
11 mol 131 unq 1 iso 0 dist 8.99949 7.31861 8.97145 9.03202 9.51418 14.8011 numMergedOcc 0
12 mol 131 unq 2 iso 0 dist 8.99949 4.55152 6.5874 9.45501 6.91348 4.96935 numMergedOcc 0
13 mol 131 unq 3 iso 0 dist 8.99949 4.55152 6.5874 9.03202 9.51418 7.83921 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 7.34465 3.81784 6.42756 11.9359 6.93652 9.82776 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 6.87299 11.6781 9.18866 5.16833 8.33261 12.8257 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 7.98018 5.21836 9.16591 4.71629 7.55203 4.95416 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 6.21273 9.98645 7.31105 5.33649 6.84247 12.3402 numMergedOcc 0
18 mol 220 unq 1 iso 0 dist 6.21273 9.98645 7.31105 12.5011 6.99002 7.84277 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 9.73411 13.9782 9.33771 9.9234 6.87664 11.498 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 7.07564 14.788 9.33771 4.92261 6.87664 11.498 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 6.06422 7.10888 6.83152 5.58989 5.38637 6.03021 numMergedOcc 0
22 mol 238 unq 1 iso 0 dist 7.64276 12.2489 5.24313 13.9044 6.55759 6.03021 numMergedOcc 0
23 mol 238 unq 2 iso 0 dist 7.64276 12.2489 5.24313 13.3748 7.02475 5.27451 numMergedOcc 0
24 mol 238 unq 3 iso 0 dist 7.64276 12.2489 5.24313 11.6924 7.67322 6.23871 numMergedOcc 0
25 mol 238 unq 4 iso 0 dist 7.64276 12.2489 5.24313 5.61491 7.19008 11.3884 numMergedOcc 0
26 mol 249 unq 0 iso 0 dist 7.72708 7.82195 5.78121 6.94174 8.96876 4.16447 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 8.40766 9.93782 5.73296 5.70545 6.49982 5.28906 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 6.94113 4.96619 5.90381 8.36147 7.50578 10.8128 numMergedOcc 0
29 mol 272 unq 0 iso 0 dist 7.31993 9.00526 9.1118 13.7563 9.09992 11.5698 numMergedOcc 0
30 mol 272 unq 1 iso 0 dist 7.31993 9.00526 9.1118 5.91451 6.16449 11.0654 numMergedOcc 0
31 mol 278 unq 0 iso 0 dist 8.83775 14.331 9.82774 9.59763 6.35287 4.8589 numMergedOcc 0
