0 mol 7 unq 0 iso 0 dist 9.8603 15.8072 8.72114 15.262 11.8172 6.02702 19.4294 13.5317 4.91115 5.83658 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 8.46229 9.93406 7.32257 17.0546 10.5747 8.64915 23.1088 15.9615 14.5187 9.4523 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 9.54519 12.1061 8.4051 18.501 15.5315 7.29868 21.7789 21.1799 12.8157 6.85331 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.11056 11.095 8.60554 14.4535 10.0952 7.29868 15.446 10.4452 12.8157 6.85331 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 8.40051 4.32173 6.16347 8.6396 10.9391 7.45383 16.5953 17.4517 14.4951 8.23292 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 9.3894 11.5759 6.66772 10.2159 6.69554 9.97654 11.6406 13.5771 11.7971 9.89098 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 9.3894 11.5759 6.66772 14.8299 7.6656 7.71248 17.1193 10.7939 5.86611 7.15203 numMergedOcc 0
7 mol 206 unq 0 iso 0 dist 9.36079 10.9922 6.16414 14.4684 5.63422 7.75885 20.2824 11.1422 14.2366 7.10166 numMergedOcc 0
8 mol 206 unq 1 iso 0 dist 9.36079 10.9922 6.16414 14.4684 5.63422 7.75885 14.0235 10.4092 5.91675 9.66896 numMergedOcc 0
9 mol 206 unq 2 iso 0 dist 7.42904 8.16827 6.16414 12.7047 5.63422 7.75885 18.5085 11.1422 14.2366 7.10166 numMergedOcc 0
10 mol 206 unq 3 iso 0 dist 7.42904 8.16827 6.16414 12.7047 5.63422 7.75885 12.3868 10.4092 5.91675 9.66896 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 9.32451 16.2294 8.94014 10.7555 8.87326 8.67864 11.2275 15.5527 16.6173 8.89538 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 9.59174 5.32742 9.63959 14.8786 12.4198 9.96262 11.8561 11.9894 7.71103 7.46199 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 9.54857 8.74892 7.08526 14.0139 6.96053 7.98231 13.2213 11.1532 7.39099 6.96379 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 6.55855 6.70266 9.45514 10.0379 10.501 7.46394 17.9835 20.1235 13.6675 9.81087 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 6.55855 6.70266 9.45514 12.5213 11.7196 8.91672 13.9843 15.4388 7.28382 9.79674 numMergedOcc 0
16 mol 274 unq 2 iso 0 dist 9.52894 6.70266 7.1729 10.0379 6.15918 7.46394 17.9835 15.0228 13.6675 9.81087 numMergedOcc 0
17 mol 274 unq 3 iso 0 dist 9.52894 6.70266 7.1729 12.5213 10.0083 8.91672 13.9843 10.3376 7.28382 9.79674 numMergedOcc 0
