0 mol 15 unq 0 iso 0 dist 6.82187 7.49229 5.89412 8.83891 6.91314 6.23015 6.3431 11.3543 10.1154 8.85174 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.0319 15.919 9.01567 15.9164 8.91183 6.19899 18.7816 11.0194 4.50066 5.68215 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.0319 15.2997 7.29868 15.9164 8.91183 6.61696 18.7816 11.0194 5.11617 5.68215 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 8.0319 15.2997 7.29868 12.1911 5.69214 5.80953 11.4109 6.86014 8.52463 7.95042 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.23812 14.7042 9.24757 13.1768 6.20232 8.96616 9.59988 6.19304 6.56633 8.68662 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 7.23812 14.7042 9.24757 12.8474 5.70116 6.14542 12.8453 9.96396 5.11416 9.73086 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 7.23812 14.7042 9.24757 12.8474 5.70116 6.14542 9.59988 6.19304 6.56633 7.4369 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 7.689 12.5859 7.01812 11.7018 4.03277 6.59691 14.9329 9.60661 5.80144 8.91882 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 7.689 12.5859 7.01812 11.7018 4.03277 6.59691 15.1707 10.1489 5.42531 9.21662 numMergedOcc 0
9 mol 100 unq 2 iso 0 dist 9.22737 10.6748 8.30845 13.861 6.23008 6.59691 6.60925 6.65086 5.80144 8.91882 numMergedOcc 0
10 mol 100 unq 3 iso 0 dist 9.22737 10.6748 8.30845 13.861 6.23008 6.59691 15.785 13.2001 5.42531 9.21662 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 9.41191 13.7792 7.80523 14.206 5.00433 7.56755 19.574 13.1098 10.0688 9.89083 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 9.41191 13.7792 7.80523 14.206 5.00433 7.56755 12.7291 8.69985 7.74599 8.52024 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 8.97762 11.4871 6.16242 11.716 13.0405 8.83732 9.74121 6.29155 4.54648 8.77023 numMergedOcc 0
14 mol 155 unq 0 iso 0 dist 8.57712 10.7516 6.53347 8.99128 7.10286 9.24038 14.7612 10.7829 6.89781 8.97626 numMergedOcc 0
15 mol 170 unq 0 iso 0 dist 9.32245 4.11212 6.35982 9.66676 4.78249 6.47164 11.4871 12.8281 9.275 9.08274 numMergedOcc 0
16 mol 170 unq 1 iso 0 dist 9.32245 4.11212 6.35982 9.66676 4.78249 6.47164 6.45787 9.76807 4.34698 9.51256 numMergedOcc 0
17 mol 170 unq 2 iso 0 dist 9.32245 9.2613 7.51126 9.66676 4.78249 9.65126 11.4871 12.8281 12.5696 9.08274 numMergedOcc 0
18 mol 170 unq 3 iso 0 dist 9.32245 9.2613 7.51126 9.66676 4.78249 9.65126 6.45787 9.76807 5.75144 9.51256 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 7.7544 7.18433 9.39829 5.97971 5.71898 5.99437 10.8374 7.81386 7.20191 9.01624 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 7.7544 7.18433 9.39829 5.97971 5.71898 5.99437 4.62576 9.81747 5.48529 5.05973 numMergedOcc 0
21 mol 181 unq 2 iso 0 dist 7.7544 7.18433 9.39829 9.30874 5.83796 8.4848 10.8374 7.81386 7.20191 9.55105 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 8.41236 11.7852 7.46394 11.3844 5.22914 7.77765 19.4766 12.3938 9.5468 9.30212 numMergedOcc 0
23 mol 274 unq 1 iso 0 dist 8.41236 11.7852 7.46394 21.2208 14.7507 9.65868 19.4766 12.3938 9.5468 6.4611 numMergedOcc 0
