0 mol 16 unq 0 iso 0 dist 6.68517 6.65577 6.75381 10.1407 8.47315 5.48497 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 5.8992 5.10071 7.03274 5.18488 6.7763 5.35612 numMergedOcc 0
2 mol 94 unq 0 iso 0 dist 6.31237 6.3708 8.13248 11.0606 9.33801 9.27318 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 6.99793 9.74115 7.91231 5.67441 7.25166 12.5962 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 9.50575 4.97528 6.3982 9.78923 6.7225 5.93926 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 8.43116 10.0493 6.3982 7.46653 6.7225 5.93926 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 4.68975 4.68337 8.31743 8.95641 7.78849 8.14784 numMergedOcc 0
7 mol 176 unq 0 iso 0 dist 8.78509 4.91512 9.84636 12.526 9.03194 16.2248 numMergedOcc 0
8 mol 197 unq 0 iso 0 dist 7.70631 4.48352 9.00273 16.2482 8.64255 17.3985 numMergedOcc 0
9 mol 197 unq 1 iso 0 dist 7.70631 5.0414 7.19387 16.2482 8.64255 14.5201 numMergedOcc 0
10 mol 206 unq 0 iso 0 dist 6.22964 7.72978 6.18991 5.85716 9.38127 7.14522 numMergedOcc 0
11 mol 206 unq 1 iso 0 dist 6.22964 7.72978 6.18991 8.09615 6.97859 6.08627 numMergedOcc 0
12 mol 206 unq 2 iso 0 dist 6.22964 6.21219 8.68547 5.85716 9.38127 4.44813 numMergedOcc 0
13 mol 206 unq 3 iso 0 dist 6.22964 6.21219 8.68547 8.09615 6.97859 7.78218 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.14644 7.55963 9.05754 14.5536 7.31105 11.6352 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 9.39537 10.2639 9.94587 6.39493 9.75174 15.1802 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 8.82778 15.973 9.73858 12.7518 6.37342 11.2409 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 6.26533 8.41952 9.13483 6.20948 8.69184 4.43997 numMergedOcc 0
18 mol 257 unq 1 iso 0 dist 6.26533 5.44976 5.16581 6.20948 8.69184 3.72932 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.38793 7.48053 5.37894 12.7183 6.60309 5.44615 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 7.151 7.90123 5.22392 13.1772 9.98528 14.247 numMergedOcc 0
21 mol 277 unq 2 iso 0 dist 8.53324 6.5109 8.23147 7.09461 9.02914 11.3539 numMergedOcc 0
22 mol 277 unq 3 iso 0 dist 8.53324 7.90123 8.20217 7.09461 9.02914 13.4481 numMergedOcc 0
23 mol 277 unq 4 iso 0 dist 7.23956 13.4588 6.86014 7.09461 6.90434 9.93994 numMergedOcc 0
24 mol 277 unq 5 iso 0 dist 7.23956 6.34637 5.97073 7.09461 6.90434 9.83255 numMergedOcc 0
25 mol 277 unq 6 iso 0 dist 7.23956 6.5109 6.49176 7.09461 6.90434 11.3539 numMergedOcc 0
26 mol 277 unq 7 iso 0 dist 8.33977 4.10842 5.22392 17.7336 9.98528 14.247 numMergedOcc 0
27 mol 277 unq 8 iso 0 dist 8.66941 8.42001 8.23147 16.013 9.02914 11.3539 numMergedOcc 0
28 mol 277 unq 9 iso 0 dist 8.66941 4.10842 8.20217 16.013 9.02914 13.4481 numMergedOcc 0
29 mol 278 unq 0 iso 0 dist 9.91518 17.7311 8.62414 5.49004 9.82774 18.1946 numMergedOcc 0
