0 mol 0 unq 0 iso 0 dist 7.65806 9.72725 6.0225 9.64573 9.19007 6.94943 12.7627 7.02374 4.22598 7.92928 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.41585 9.87885 12.8323 10.2446 7.88043 8.15894 10.672 12.2708 4.40641 9.55056 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 8.41585 9.87885 12.8323 10.2446 7.88043 8.15894 6.36911 6.06176 7.92429 7.45262 numMergedOcc 0
3 mol 7 unq 2 iso 0 dist 8.41585 9.87885 12.8323 12.3097 8.80762 8.45544 10.672 12.2708 4.40641 7.57354 numMergedOcc 0
4 mol 7 unq 3 iso 0 dist 8.41585 9.87885 12.8323 12.3097 8.80762 8.45544 6.36911 6.06176 7.92429 6.96586 numMergedOcc 0
5 mol 7 unq 4 iso 0 dist 7.10621 6.1206 7.12508 5.44992 5.72491 8.15894 7.31201 10.789 4.40641 9.55056 numMergedOcc 0
6 mol 7 unq 5 iso 0 dist 7.10621 6.1206 7.12508 5.44992 5.72491 8.15894 9.36807 10.515 7.92429 7.45262 numMergedOcc 0
7 mol 7 unq 6 iso 0 dist 7.10621 6.1206 7.12508 4.74523 9.67579 8.45544 7.31201 10.789 4.40641 7.57354 numMergedOcc 0
8 mol 7 unq 7 iso 0 dist 7.10621 6.1206 7.12508 4.74523 9.67579 8.45544 9.36807 10.515 7.92429 6.96586 numMergedOcc 0
9 mol 9 unq 0 iso 0 dist 8.57077 5.8245 5.84314 3.98483 9.78006 7.05919 8.47421 5.60154 3.91075 8.04924 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 7.71338 8.47988 6.95317 8.56707 6.43433 4.99604 11.6597 6.72991 4.89178 7.82011 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 7.30858 6.04595 5.03039 5.61704 5.72642 8.4965 11.695 11.7126 13.2709 9.9928 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 5.99315 5.37047 4.78563 9.23795 7.25673 8.612 9.27292 6.01455 4.38322 7.88655 numMergedOcc 0
13 mol 178 unq 0 iso 0 dist 6.69288 7.06025 6.42973 10.1489 4.92088 8.25282 10.5498 5.25267 5.88866 5.98771 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 6.03031 6.52816 9.49403 5.54129 10.8209 7.53395 9.19704 8.66809 13.4094 9.83885 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 7.26832 6.52816 13.514 5.54129 10.0424 7.53395 9.19704 6.23291 13.4094 9.83885 numMergedOcc 0
16 mol 205 unq 2 iso 0 dist 7.80463 6.52816 3.56269 5.54129 10.03 7.53395 9.19704 13.231 13.4094 9.83885 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 7.22101 5.23634 5.0317 10.5813 8.03442 9.43618 8.17891 6.43754 4.09934 7.1372 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 8.65997 6.91318 5.0317 7.22396 8.03442 9.43618 6.95902 6.43754 4.09934 7.1372 numMergedOcc 0
19 mol 227 unq 2 iso 0 dist 7.09863 5.23634 5.83175 10.5813 12.2278 9.43618 8.17891 9.13836 4.09934 7.1372 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 5.72887 9.72188 7.06793 10.7551 11.2809 6.53286 12.1104 13.7993 9.75095 7.61203 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 5.72887 9.72188 7.06793 10.7551 11.2809 6.53286 9.29858 13.069 11.7938 9.47845 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 5.72887 9.72188 7.06793 10.7551 11.2809 6.53286 10.7386 14.2103 11.7709 6.92409 numMergedOcc 0
23 mol 238 unq 3 iso 0 dist 5.72887 9.72188 7.06793 10.7551 11.2809 6.53286 15.0465 13.193 6.12722 6.89694 numMergedOcc 0
24 mol 238 unq 4 iso 0 dist 7.31233 9.12776 10.3162 11.0349 11.9624 6.53286 7.67322 12.6986 9.75095 7.61203 numMergedOcc 0
25 mol 238 unq 5 iso 0 dist 7.31233 9.12776 10.3162 11.0349 11.9624 6.53286 12.3367 17.6075 11.7938 9.47845 numMergedOcc 0
26 mol 238 unq 6 iso 0 dist 7.31233 9.12776 10.3162 11.0349 11.9624 6.53286 13.5581 17.0242 11.7709 6.92409 numMergedOcc 0
27 mol 238 unq 7 iso 0 dist 7.31233 9.12776 10.3162 11.0349 11.9624 6.53286 7.19008 5.17471 6.12722 6.89694 numMergedOcc 0
28 mol 252 unq 0 iso 0 dist 7.19638 7.15764 7.40852 13.9054 10.7615 9.39658 14.7097 9.37715 9.43777 6.57207 numMergedOcc 0
