0 mol 0 unq 0 iso 0 dist 9.42137 7.31837 5.24778 8.60656 7.40865 10.4616 3.69299 10.7845 9.38507 9.12959 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 6.51397 9.99657 6.96891 4.27486 9.47063 10.9812 14.634 12.0338 8.59513 13.609 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 6.51397 9.99657 6.96891 4.27486 9.47063 10.9812 12.8646 8.14998 6.59312 13.4984 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 9.44909 9.45566 4.55437 4.83412 9.6782 7.48846 12.2887 11.0768 6.53981 8.06674 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 5.97635 4.38047 4.29856 11.5332 7.21717 10.7227 2.97898 8.31068 5.27979 14.2852 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 6.36193 5.84625 9.95364 4.37642 5.93884 10.2007 6.09663 9.9105 6.41008 8.76454 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 4.88613 5.84625 5.49591 4.37642 7.68678 10.2007 6.09663 7.17488 6.41008 8.76454 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.4545 7.11438 9.52327 12.49 8.18107 13.7988 12.6706 12.1221 8.4219 11.176 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 8.4545 7.11438 9.52327 4.1125 5.9465 5.50508 12.6706 12.1221 8.4219 9.18008 numMergedOcc 0
9 mol 92 unq 2 iso 0 dist 7.01176 7.11438 11.641 12.49 9.8859 13.7988 12.6706 15.3733 8.4219 11.176 numMergedOcc 0
10 mol 92 unq 3 iso 0 dist 7.01176 7.11438 11.641 4.1125 6.97962 5.50508 12.6706 15.3733 8.4219 9.18008 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 5.9747 9.25249 14.3413 7.43001 6.65501 16.102 4.48773 7.92856 7.55367 11.6496 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.40546 8.4733 7.45148 5.73999 8.99399 7.20249 3.80816 7.60162 6.21165 5.77063 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.58911 5.66363 11.85 12.0718 6.22122 12.1629 3.55808 9.70481 9.20617 13.4378 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 9.11298 9.7402 4.51687 7.56231 7.29285 10.334 10.8126 8.65714 5.17607 14.2211 numMergedOcc 0
15 mol 206 unq 1 iso 0 dist 7.42904 9.7402 4.62682 8.16827 6.16414 10.7298 10.8126 4.51255 5.17607 9.36584 numMergedOcc 0
16 mol 206 unq 2 iso 0 dist 7.42904 9.7402 4.62682 6.06766 7.33701 10.985 10.8126 4.51255 5.17607 8.97305 numMergedOcc 0
17 mol 206 unq 3 iso 0 dist 7.42904 9.7402 4.62682 5.82916 8.0871 9.9584 10.8126 4.51255 5.17607 8.90838 numMergedOcc 0
