0 mol 1 unq 0 iso 0 dist 5.87976 9.48433 6.35409 8.79999 6.22606 7.75803 numMergedOcc 0
1 mol 52 unq 0 iso 0 dist 8.87569 8.52979 10.8037 5.19329 5.45185 6.61767 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 8.23695 8.74231 13.2118 8.33803 6.02306 10.113 numMergedOcc 0
3 mol 63 unq 1 iso 0 dist 7.04212 8.74231 10.7769 8.33803 5.85338 10.113 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.07638 8.85981 8.60018 9.9901 9.30021 10.9766 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.07638 9.37314 5.96946 9.9901 9.30021 5.1943 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 6.79787 8.85981 7.06343 9.9901 6.30613 10.9766 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 6.79787 9.37314 3.27963 9.9901 6.30613 5.1943 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.76383 5.17291 7.19147 8.1489 4.28388 9.19822 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 4.3761 9.58693 8.91618 6.91361 3.92844 6.38138 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 4.3761 9.48388 12.3835 6.91361 3.92844 14.5341 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 5.84583 9.58693 12.9994 6.91361 10.8121 6.38138 numMergedOcc 0
12 mol 98 unq 3 iso 0 dist 5.84583 9.48388 4.96747 6.91361 10.8121 14.5341 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 8.22824 7.31419 5.73965 5.10248 4.02705 6.02179 numMergedOcc 0
14 mol 135 unq 0 iso 0 dist 6.1777 8.24228 5.49259 5.06602 7.00502 4.98533 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 8.30819 8.68992 10.5731 9.08829 13.9427 5.72949 numMergedOcc 0
16 mol 171 unq 1 iso 0 dist 8.30819 8.68992 10.5731 5.94881 14.0377 12.7692 numMergedOcc 0
17 mol 173 unq 0 iso 0 dist 8.91036 9.72828 10.8336 7.38163 15.0429 10.6059 numMergedOcc 0
18 mol 229 unq 0 iso 0 dist 8.17234 9.48923 9.29848 5.67652 7.78418 5.14473 numMergedOcc 0
19 mol 229 unq 1 iso 0 dist 8.17234 9.67544 6.21233 5.67652 7.78418 7.7339 numMergedOcc 0
20 mol 233 unq 0 iso 0 dist 8.73545 4.94074 6.52848 9.63438 5.72267 8.2372 numMergedOcc 0
21 mol 233 unq 1 iso 0 dist 8.14581 4.94074 5.51 9.63438 13.5353 8.2372 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 6.28725 9.5181 6.94762 8.23512 6.83465 5.6819 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 5.03174 8.43682 5.21164 8.43465 6.63115 6.84156 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 5.03174 6.20796 6.12009 8.43465 6.63115 9.37297 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 6.84909 6.02089 9.83514 9.97806 9.67324 6.27903 numMergedOcc 0
26 mol 292 unq 1 iso 0 dist 6.84909 6.87804 8.04474 9.97806 9.67324 15.2894 numMergedOcc 0
