0 mol 9 unq 0 iso 0 dist 8.46229 9.93406 7.32257 13.6879 8.50424 7.35972 13.769 12.7944 13.9252 9.57198 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 5.95165 4.46394 5.96346 11.7593 10.7734 7.98326 12.0868 10.0658 8.17605 9.09091 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 5.7435 4.24301 6.35398 11.4417 10.9183 7.98326 11.1513 9.53002 7.5901 8.73067 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 8.88413 10.7087 7.55264 18.0075 10.4337 8.88938 16.4071 11.7303 6.06874 6.63839 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.5819 4.00923 7.52354 13.887 14.3301 9.91054 8.6391 11.3654 5.54732 6.95465 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.9747 7.43001 6.65501 10.9995 7.06961 6.88901 12.8333 10.417 5.71029 6.0129 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 4.50572 9.5305 6.65501 11.1541 7.06961 6.88901 14.3306 10.417 5.71029 6.0129 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 6.40546 5.73999 8.99399 8.4733 7.45148 7.20249 6.02826 10.5042 4.48922 7.26955 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 9.58911 12.0718 6.22122 15.9008 13.0409 8.86197 17.8459 13.1996 7.23063 6.32777 numMergedOcc 0
9 mol 232 unq 0 iso 0 dist 7.70279 6.36084 8.50102 9.41148 6.2188 9.78181 6.17401 7.07392 10.9886 7.10413 numMergedOcc 0
10 mol 232 unq 1 iso 0 dist 9.29752 6.36084 9.40808 9.41148 12.5452 9.78181 6.17401 11.5589 10.9886 7.10413 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 9.32451 16.2294 8.94014 11.4318 5.50308 5.92374 15.5522 10.6978 4.38002 6.62002 numMergedOcc 0
12 mol 238 unq 1 iso 0 dist 9.32451 16.2294 8.94014 11.4318 5.50308 5.92374 6.67841 11.1159 14.6816 9.69818 numMergedOcc 0
13 mol 238 unq 2 iso 0 dist 9.32451 16.2294 8.94014 11.4318 5.50308 5.92374 4.81145 6.05141 11.5793 6.73446 numMergedOcc 0
14 mol 271 unq 0 iso 0 dist 9.56149 6.15348 9.70714 10.9613 8.66946 5.92274 8.74529 11.1285 4.51983 5.81266 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 6.55855 5.15747 6.39866 6.83113 5.64601 9.16942 5.95459 9.19234 4.60275 9.20749 numMergedOcc 0
16 mol 274 unq 1 iso 0 dist 9.71801 4.36131 8.52587 11.74 16.3619 9.16942 5.89955 12.5979 4.60275 9.20749 numMergedOcc 0
