0 mol 34 unq 0 iso 0 dist 9.10681 12.1733 5.46305 8.3237 9.36493 13.3443 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 9.10681 12.1733 5.46305 11.3659 9.0665 9.4154 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 9.10681 12.1733 5.46305 15.0854 7.07773 4.24673 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 9.0802 9.69205 9.54121 4.12203 9.09778 9.88278 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 6.1517 3.75636 5.8101 6.74214 7.55443 9.55746 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 6.05736 10.6121 8.58853 9.87425 6.82267 9.45081 numMergedOcc 0
6 mol 116 unq 1 iso 0 dist 8.34007 4.48612 8.58853 6.88393 6.82267 9.45081 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 7.2409 3.34698 6.23725 3.35238 8.84926 6.01298 numMergedOcc 0
8 mol 172 unq 0 iso 0 dist 9.40213 7.78818 7.40111 6.2666 7.3485 8.97614 numMergedOcc 0
9 mol 172 unq 1 iso 0 dist 8.75042 3.9784 7.40111 11.7152 7.3485 8.97614 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 8.36606 5.73429 6.50723 3.84631 9.95907 5.64063 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 9.26044 7.3483 7.9267 11.2097 7.14918 5.98994 numMergedOcc 0
12 mol 239 unq 1 iso 0 dist 9.26044 7.3483 7.9267 6.10489 9.29322 11.6074 numMergedOcc 0
13 mol 257 unq 0 iso 0 dist 8.5835 7.38093 6.83847 3.41163 8.81508 5.43533 numMergedOcc 0
14 mol 261 unq 0 iso 0 dist 7.22085 6.16362 7.59719 4.0358 9.90119 7.13646 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 9.92578 10.4463 8.85191 3.53612 7.70811 10.0787 numMergedOcc 0
