0 mol 123 unq 0 iso 0 dist 7.99359 9.14514 13.8924 6.36344 9.13867 7.70166 numMergedOcc 0
1 mol 123 unq 0 iso 1 dist 9.14514 7.99359 13.8924 6.36344 7.70166 9.13867 numMergedOcc 0
2 mol 136 unq 0 iso 0 dist 5.00698 8.99371 10.9648 8.7469 12.9876 10.8346 numMergedOcc 0
3 mol 136 unq 0 iso 1 dist 8.99371 5.00698 10.9648 8.7469 10.8346 12.9876 numMergedOcc 0
4 mol 136 unq 1 iso 0 dist 5.00698 8.99371 10.9648 9.89967 8.94322 10.4328 numMergedOcc 0
5 mol 136 unq 1 iso 1 dist 8.99371 5.00698 10.9648 9.89967 10.4328 8.94322 numMergedOcc 0
6 mol 158 unq 0 iso 0 dist 9.94593 9.49329 17.5056 9.83634 19.7101 9.82006 numMergedOcc 0
7 mol 158 unq 0 iso 1 dist 9.49329 9.94593 17.5056 9.83634 9.82006 19.7101 numMergedOcc 0
8 mol 175 unq 0 iso 0 dist 6.79646 8.41614 4.6893 8.12739 4.44885 4.81365 numMergedOcc 0
9 mol 175 unq 0 iso 1 dist 8.41614 6.79646 4.6893 8.12739 4.81365 4.44885 numMergedOcc 0
10 mol 188 unq 0 iso 0 dist 8.48704 7.22511 8.75579 5.4981 5.51595 4.54544 numMergedOcc 0
11 mol 188 unq 0 iso 1 dist 7.22511 8.48704 8.75579 5.4981 4.54544 5.51595 numMergedOcc 0
12 mol 223 unq 0 iso 0 dist 4.30445 9.10041 7.75335 6.33896 5.30247 11.0723 numMergedOcc 0
13 mol 223 unq 0 iso 1 dist 9.10041 4.30445 7.75335 6.33896 11.0723 5.30247 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 9.4961 8.08479 8.19601 6.55208 15.1918 14.4541 numMergedOcc 0
15 mol 266 unq 0 iso 1 dist 8.08479 9.4961 8.19601 6.55208 14.4541 15.1918 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 7.07099 8.83873 11.6004 7.17562 9.54337 10.2796 numMergedOcc 0
17 mol 266 unq 1 iso 1 dist 8.83873 7.07099 11.6004 7.17562 10.2796 9.54337 numMergedOcc 0
18 mol 266 unq 2 iso 0 dist 7.07099 8.3978 13.1611 7.17562 9.54337 15.1918 numMergedOcc 0
19 mol 266 unq 2 iso 1 dist 8.3978 7.07099 13.1611 7.17562 15.1918 9.54337 numMergedOcc 0
20 mol 266 unq 2 iso 0 dist 8.83873 8.3978 14.3542 7.17562 10.2796 15.1918 numMergedOcc 0
21 mol 266 unq 2 iso 1 dist 8.3978 8.83873 14.3542 7.17562 15.1918 10.2796 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 9.04355 8.50508 10.6227 7.78656 4.38561 10.9625 numMergedOcc 0
23 mol 287 unq 0 iso 1 dist 8.50508 9.04355 10.6227 7.78656 10.9625 4.38561 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 9.04355 8.50508 10.6227 7.78656 4.38561 10.9625 numMergedOcc 0
25 mol 288 unq 0 iso 1 dist 8.50508 9.04355 10.6227 7.78656 10.9625 4.38561 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 9.04355 8.50508 10.6227 7.78656 4.38561 10.9625 numMergedOcc 0
27 mol 289 unq 0 iso 1 dist 8.50508 9.04355 10.6227 7.78656 10.9625 4.38561 numMergedOcc 0
