0 mol 60 unq 0 iso 0 dist 6.27749 11.7103 8.82176 12.6126 7.1082 6.46718 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 9.02288 6.28525 8.03303 10.1296 6.28792 8.59337 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.02288 6.28525 8.03303 11.0617 4.4893 7.66942 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 9.58544 5.32605 8.03303 12.855 6.28792 8.59337 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 9.58544 5.32605 8.03303 8.14547 4.4893 7.66942 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 6.31633 5.70461 8.67766 13.2944 10.8085 9.67274 numMergedOcc 0
6 mol 109 unq 1 iso 0 dist 7.21115 5.70461 8.0831 13.2944 10.1337 9.67274 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.42766 16.5854 8.56342 20.6456 13.2169 7.62197 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 8.89982 10.4193 9.77552 15.8717 10.6994 7.34557 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 9.82249 5.16577 6.20182 13.3216 4.51281 9.56342 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 9.00898 15.1521 7.35824 19.3305 10.7092 6.90373 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.66381 5.77691 6.258 7.005 4.04122 6.08596 numMergedOcc 0
12 mol 188 unq 0 iso 0 dist 9.24118 11.8438 8.57261 15.184 8.02684 6.18257 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 6.47339 10.1932 8.10985 9.48314 4.27652 5.20846 numMergedOcc 0
14 mol 230 unq 0 iso 0 dist 8.49299 11.9554 6.41286 17.218 10.043 6.31092 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 7.7993 5.75734 7.77998 14.939 14.6881 9.86765 numMergedOcc 0
16 mol 253 unq 1 iso 0 dist 7.7993 5.75734 7.77998 10.8796 9.46115 6.3738 numMergedOcc 0
17 mol 253 unq 2 iso 0 dist 6.10761 10.1636 7.77998 19.0517 14.6881 9.86765 numMergedOcc 0
18 mol 253 unq 3 iso 0 dist 6.10761 10.1636 7.77998 14.3387 9.46115 6.3738 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 5.81927 6.31492 8.15467 9.30975 5.82277 9.12447 numMergedOcc 0
20 mol 258 unq 1 iso 0 dist 6.09782 6.31492 9.1925 9.30975 4.83605 9.12447 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 9.02749 9.5741 7.44083 12.8636 6.91483 9.76998 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.98528 7.01469 6.57903 11.7725 14.3711 8.78893 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 9.12049 8.9468 8.0241 10.126 4.50378 9.18236 numMergedOcc 0
