0 mol 19 unq 0 iso 0 dist 9.82581 8.96529 13.4477 7.19503 9.50382 10.8249 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.73869 9.04237 8.01112 10.7288 8.28883 14.5932 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 6.60395 5.04007 7.08944 6.81881 8.76389 10.14 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.52544 8.08674 10.0928 6.1691 7.02854 12.4201 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 7.52544 8.33694 9.19938 6.1691 7.02854 12.6506 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 5.2929 6.17589 7.12394 5.93926 7.67341 11.1256 numMergedOcc 0
6 mol 218 unq 0 iso 0 dist 6.35646 5.59354 6.98423 5.01938 4.61671 8.44004 numMergedOcc 0
7 mol 218 unq 1 iso 0 dist 5.59354 6.35646 6.98423 5.01938 8.44004 4.61671 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 9.66105 9.64006 14.0751 10.0531 8.5434 17.1649 numMergedOcc 0
9 mol 220 unq 1 iso 0 dist 9.64006 9.66105 14.0751 16.6231 7.86207 18.384 numMergedOcc 0
10 mol 245 unq 0 iso 0 dist 5.70624 6.58523 6.87629 4.84566 7.26913 10.5586 numMergedOcc 0
11 mol 245 unq 1 iso 0 dist 5.70624 6.58523 6.87629 11.4898 6.41862 12.9801 numMergedOcc 0
12 mol 245 unq 2 iso 0 dist 5.70624 6.58523 6.87629 13.484 8.69377 13.5909 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 9.98041 8.43646 10.1612 11.5702 6.76656 15.6721 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 8.78501 5.59641 8.19601 12.4808 8.12204 14.1332 numMergedOcc 0
15 mol 271 unq 0 iso 0 dist 8.99843 9.01599 5.54816 9.71842 8.07242 12.578 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 9.60879 6.92271 11.3688 9.93994 6.23539 12.4458 numMergedOcc 0
17 mol 281 unq 0 iso 0 dist 9.83857 9.53816 7.20467 5.58886 6.7897 10.2015 numMergedOcc 0
