0 mol 7 unq 0 iso 0 dist 8.75465 6.3236 6.1206 12.8676 7.12508 7.10621 12.777 11.1727 6.96396 6.22805 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.00249 6.3236 7.67927 12.8676 11.143 7.10621 12.777 13.8869 6.96396 6.22805 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 5.59847 5.51815 6.54358 6.49709 4.10106 4.61088 11.1196 9.33059 5.9863 6.40513 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.6834 13.4994 7.95042 9.88461 5.69214 6.86014 13.9612 8.14598 9.20254 6.85331 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 9.23015 10.7149 7.05196 13.2682 6.47509 5.04899 20.9621 14.1443 12.4427 8.23292 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 8.57607 4.16047 8.27883 11.3191 15.6249 8.03644 15.9207 15.1845 11.8978 9.40559 numMergedOcc 0
6 mol 95 unq 1 iso 0 dist 6.1991 4.16047 5.75428 11.3191 12.4896 8.03644 15.9207 15.1965 11.8978 9.40559 numMergedOcc 0
7 mol 95 unq 2 iso 0 dist 5.96246 4.16047 8.57395 11.3191 14.2178 8.03644 15.9207 20.1016 11.8978 9.40559 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.90992 12.718 7.69765 18.5013 10.3209 7.30858 20.1961 14.5979 7.64822 7.44784 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 9.90992 12.718 7.69765 16.7328 11.835 7.88312 20.1961 14.5979 7.64822 9.56867 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 7.76446 10.4858 9.1998 10.5814 15.0225 9.71307 15.4806 19.6139 12.4156 5.67862 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 6.14652 7.07625 9.33094 10.5814 10.8635 6.37586 15.4806 16.1624 9.52819 5.67862 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 6.14652 7.07625 9.33094 9.42271 12.3479 6.49416 15.4806 16.1624 9.52819 7.97208 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 6.14652 10.4858 8.69531 10.5814 10.8635 9.71307 15.4806 16.1624 12.4156 5.67862 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 9.11314 10.5234 5.37047 12.9413 4.78563 5.99315 15.6254 9.33882 5.11989 7.5984 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 8.63804 4.81906 5.56538 11.4413 6.84862 7.21333 11.8601 13.422 9.97859 8.69148 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 8.61619 4.81906 7.48954 11.4413 9.53117 7.21333 11.8601 15.096 9.97859 8.69148 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 7.88009 9.57081 8.9682 16.2514 17.6038 9.7748 10.1327 9.91103 5.77904 8.35794 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 5.80061 9.57081 6.92711 16.2514 14.772 9.7748 10.1327 7.0603 5.77904 8.35794 numMergedOcc 0
