0 mol 7 unq 0 iso 0 dist 6.10226 8.88982 5.70161 14.92 10.0459 8.72114 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.80034 8.88982 4.57188 14.92 10.4728 8.72114 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.83056 8.88982 6.09254 14.92 12.8055 8.72114 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 8.36361 5.38103 5.31774 6.23859 6.0266 7.47858 numMergedOcc 0
4 mol 16 unq 1 iso 0 dist 9.49518 6.60918 6.25083 5.9861 6.0266 6.62144 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 9.67926 8.13365 10.0637 7.1011 14.9399 7.33768 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 9.67926 8.13365 10.0637 10.8208 15.5426 9.01567 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 9.67926 8.13365 10.0637 13.3998 15.1929 7.29868 numMergedOcc 0
8 mol 30 unq 0 iso 0 dist 7.75901 9.28346 5.17518 6.51677 9.43959 7.12365 numMergedOcc 0
9 mol 33 unq 0 iso 0 dist 9.69775 9.8294 17.9599 4.41482 13.4489 8.83487 numMergedOcc 0
10 mol 33 unq 1 iso 0 dist 9.01202 9.8294 15.1668 4.41482 12.8719 8.83487 numMergedOcc 0
11 mol 108 unq 0 iso 0 dist 8.84888 5.45787 12.692 5.35819 8.06774 9.01852 numMergedOcc 0
12 mol 108 unq 1 iso 0 dist 8.84888 5.45787 12.692 6.01187 12.8869 9.75958 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 9.79676 7.94863 11.8666 8.93581 13.0056 7.96646 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 9.38695 9.25604 13.6345 11.2214 15.6157 8.73722 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.02183 8.80581 5.16386 10.5065 10.9743 5.9176 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 9.02183 8.80581 5.16386 6.04759 6.66608 6.41453 numMergedOcc 0
17 mol 196 unq 0 iso 0 dist 6.51568 4.97115 9.47778 7.68725 14.103 6.70531 numMergedOcc 0
18 mol 196 unq 1 iso 0 dist 6.51568 7.23126 12.5715 7.68725 14.103 6.86319 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 7.9678 6.04106 6.4623 4.45301 6.05667 5.44002 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 7.37405 6.15754 6.00143 14.7836 13.8712 9.81425 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 9.42966 6.6281 6.00143 10.5885 13.8712 9.81425 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.86905 6.51823 7.22173 12.1252 13.6546 8.67864 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 5.14122 7.83102 5.56416 4.40079 7.49913 6.71375 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 8.45634 8.99442 13.9754 8.70711 16.4005 7.83341 numMergedOcc 0
