0 mol 5 unq 0 iso 0 dist 5.63583 9.8143 7.05332 6.86774 6.96805 12.2642 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 8.44753 8.09271 7.3232 10.2117 9.00405 14.7207 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 8.44753 8.09271 7.3232 5.07575 5.06756 9.23947 numMergedOcc 0
3 mol 124 unq 0 iso 0 dist 6.31232 7.3864 6.14262 6.70976 9.7589 13.2972 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 8.95717 8.98949 10.4812 9.30741 9.09918 16.1271 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 9.89671 9.13917 5.25819 12.4418 7.67877 10.2936 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 4.46578 6.53862 8.13581 6.53566 5.9962 12.2067 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 4.46578 6.53862 8.13581 4.77272 8.61448 5.84909 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 6.5782 8.68179 8.17747 5.79787 9.65404 11.7751 numMergedOcc 0
9 mol 167 unq 1 iso 0 dist 6.5782 5.32056 4.49322 5.79787 9.65404 8.39087 numMergedOcc 0
10 mol 167 unq 2 iso 0 dist 6.5782 9.52659 5.79931 5.79787 9.65404 13.6444 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 9.58783 9.6856 17.0492 9.46815 9.60268 16.39 numMergedOcc 0
12 mol 168 unq 1 iso 0 dist 9.58783 9.6856 17.0492 5.35061 8.79954 12.9697 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 7.6174 9.82101 12.0828 13.1272 7.54614 19.2272 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 7.5099 6.58227 4.40152 5.49245 6.87565 8.39315 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.00773 6.9659 4.91848 5.22428 8.93135 7.12027 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 6.56182 8.0367 10.3845 5.45251 8.21164 10.9153 numMergedOcc 0
17 mol 247 unq 1 iso 0 dist 5.32075 8.0367 6.75612 5.45251 8.40674 10.9153 numMergedOcc 0
18 mol 254 unq 0 iso 0 dist 9.73281 9.61808 5.64395 18.0832 8.76115 12.2789 numMergedOcc 0
19 mol 276 unq 0 iso 0 dist 5.71066 7.86619 7.75603 12.7549 9.5388 14.403 numMergedOcc 0
20 mol 293 unq 0 iso 0 dist 6.02106 8.84911 5.48105 4.35498 7.67909 8.04021 numMergedOcc 0
21 mol 293 unq 1 iso 0 dist 8.27274 8.84911 4.88851 4.35498 6.83404 8.04021 numMergedOcc 0
