0 mol 11 unq 0 iso 0 dist 6.58046 7.85924 5.25331 10.7048 6.83186 3.66215 15.1065 12.0683 12.4305 9.89425 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 7.15542 4.84988 8.44353 6.88863 8.22812 4.28224 13.0948 9.26377 10.8614 7.78689 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.89047 4.84988 6.11249 6.88863 4.22002 4.28224 13.0948 4.88527 10.8614 7.78689 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 8.89003 4.84988 7.86326 6.88863 5.77855 4.28224 13.0948 4.76279 10.8614 7.78689 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 7.61521 6.06861 8.90522 10.5019 7.66068 10.865 9.76346 3.35924 10.9283 5.45099 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 7.61521 6.06861 8.90522 13.3187 9.5043 10.2651 9.76346 3.35924 10.9283 8.44765 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 7.61521 6.06861 8.90522 10.3032 8.34132 5.92868 9.76346 3.35924 10.9283 9.06643 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 4.37025 7.50972 7.08462 8.95695 6.20144 4.89844 11.2699 7.19532 8.71844 4.74254 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.99912 8.69934 5.45882 6.54263 4.49669 5.09579 14.9043 10.1118 9.85902 8.67025 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 8.99912 8.69934 5.45882 3.92558 5.88896 5.46299 11.6298 8.39067 5.29949 9.60127 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 8.99891 5.44503 8.08798 6.75249 4.3855 4.19541 5.40637 5.94217 7.46803 6.60366 numMergedOcc 0
11 mol 277 unq 0 iso 0 dist 9.54359 10.7791 9.62597 13.7583 7.98956 13.6468 13.3371 10.5214 12.3265 5.13533 numMergedOcc 0
12 mol 277 unq 1 iso 0 dist 5.69112 6.58374 9.62597 11.8607 7.98956 13.6468 12.1398 10.5214 12.3265 5.13533 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 5.30118 7.23534 5.50067 3.65199 4.68668 8.99193 7.45616 3.66473 8.59762 4.93516 numMergedOcc 0
14 mol 287 unq 1 iso 0 dist 8.98698 11.7115 5.50067 5.70614 4.68668 8.99193 10.4299 3.66473 8.59762 4.93516 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 5.30118 7.23534 5.50067 3.65199 4.68668 8.99193 7.45616 3.66473 8.59762 4.93516 numMergedOcc 0
16 mol 288 unq 1 iso 0 dist 8.98698 11.7115 5.50067 5.70614 4.68668 8.99193 10.4299 3.66473 8.59762 4.93516 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 5.30118 7.23534 5.50067 3.65199 4.68668 8.99193 7.45616 3.66473 8.59762 4.93516 numMergedOcc 0
18 mol 289 unq 1 iso 0 dist 8.98698 11.7115 5.50067 5.70614 4.68668 8.99193 10.4299 3.66473 8.59762 4.93516 numMergedOcc 0
