0 mol 13 unq 0 iso 0 dist 6.6621 9.92193 9.7299 7.5429 4.34416 6.79244 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 9.69775 9.8294 17.9599 6.84974 13.0975 8.71742 numMergedOcc 0
2 mol 33 unq 1 iso 0 dist 9.01202 9.8294 15.1668 6.84974 10.8866 8.71742 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 9.77304 6.91417 4.70362 9.01327 7.75267 7.03963 numMergedOcc 0
4 mol 108 unq 0 iso 0 dist 8.84888 5.45787 12.692 8.07863 9.27699 6.98264 numMergedOcc 0
5 mol 152 unq 0 iso 0 dist 9.59193 9.37459 13.2016 4.58432 9.46603 8.18329 numMergedOcc 0
6 mol 152 unq 1 iso 0 dist 9.59193 9.0847 14.0443 4.58432 9.46603 5.97115 numMergedOcc 0
7 mol 152 unq 2 iso 0 dist 9.59193 6.00061 7.99896 4.58432 9.46603 4.36394 numMergedOcc 0
8 mol 152 unq 3 iso 0 dist 9.59193 8.33302 4.89042 4.58432 9.46603 5.96803 numMergedOcc 0
9 mol 196 unq 0 iso 0 dist 6.51568 4.97115 9.47778 5.66536 9.57955 10.1657 numMergedOcc 0
10 mol 196 unq 1 iso 0 dist 6.51568 9.45804 9.64101 5.66536 9.57955 11.4143 numMergedOcc 0
11 mol 196 unq 2 iso 0 dist 6.51568 9.8486 9.16184 5.66536 9.57955 8.29433 numMergedOcc 0
12 mol 196 unq 3 iso 0 dist 6.51568 7.23126 12.5715 5.66536 9.57955 3.98793 numMergedOcc 0
13 mol 257 unq 0 iso 0 dist 8.42116 8.95261 5.86413 8.13651 12.2828 8.14464 numMergedOcc 0
14 mol 257 unq 1 iso 0 dist 8.53984 7.80336 5.86413 7.70445 12.2828 8.14464 numMergedOcc 0
15 mol 257 unq 2 iso 0 dist 9.11074 8.95261 13.8679 8.13651 14.818 8.14464 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.87598 5.29682 6.59107 8.42773 3.85191 4.51538 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 8.87598 6.20344 11.1778 8.42773 3.85191 9.08426 numMergedOcc 0
18 mol 265 unq 0 iso 0 dist 9.19106 7.45719 8.31727 9.59851 14.137 6.09499 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 7.02416 9.65332 13.8873 9.88046 16.5485 7.41825 numMergedOcc 0
