0 mol 43 unq 0 iso 0 dist 7.48969 9.30432 5.41731 9.62895 10.5752 13.0787 11.2822 8.60396 5.5483 17.7781 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.61209 8.57528 8.03646 7.37244 8.71074 5.50549 6.07177 5.7638 8.24934 10.1221 numMergedOcc 0
2 mol 123 unq 0 iso 0 dist 7.25497 9.14514 10.835 6.36344 4.10446 7.70166 5.29746 10.9712 6.17633 8.71375 numMergedOcc 0
3 mol 152 unq 0 iso 0 dist 8.30966 4.95077 5.3105 9.59193 8.81393 5.90316 7.21824 7.69136 5.83952 11.1538 numMergedOcc 0
4 mol 176 unq 0 iso 0 dist 9.84843 6.74185 12.5252 8.12047 16.5596 5.22451 10.7245 18.1647 9.24242 6.02559 numMergedOcc 0
5 mol 233 unq 0 iso 0 dist 6.01193 6.50096 4.69192 9.99681 6.04517 8.37757 4.36175 7.40749 9.91416 9.89626 numMergedOcc 0
6 mol 233 unq 1 iso 0 dist 7.40749 9.91416 4.69192 9.89626 6.04517 8.37757 4.36175 6.01193 6.50096 9.99681 numMergedOcc 0
7 mol 241 unq 0 iso 0 dist 9.33399 8.10031 7.72095 9.744 5.37052 5.37459 9.16111 14.5616 8.50897 11.1275 numMergedOcc 0
8 mol 241 unq 1 iso 0 dist 9.33399 8.10031 7.72095 7.62827 4.58303 5.02153 9.16111 14.5616 8.50897 12.493 numMergedOcc 0
9 mol 266 unq 0 iso 0 dist 9.8678 9.4961 17.1354 6.55208 4.98576 15.1918 4.34107 9.10275 8.3978 7.17562 numMergedOcc 0
10 mol 266 unq 1 iso 0 dist 8.00278 9.4961 14.487 6.55208 4.0473 15.1918 4.34107 6.13722 8.3978 7.17562 numMergedOcc 0
11 mol 266 unq 2 iso 0 dist 9.10275 8.3978 17.1354 7.17562 4.98576 15.1918 4.34107 9.8678 9.4961 6.55208 numMergedOcc 0
12 mol 266 unq 3 iso 0 dist 6.13722 8.3978 14.487 7.17562 4.0473 15.1918 4.34107 8.00278 9.4961 6.55208 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 7.75212 8.50508 11.7739 7.78656 5.10813 10.9625 6.47102 13.3376 7.64715 13.5508 numMergedOcc 0
14 mol 287 unq 1 iso 0 dist 7.90634 8.50508 5.27724 7.78656 7.51649 10.9625 6.47102 10.0327 7.64715 13.5508 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 7.75212 8.50508 11.7739 7.78656 5.10813 10.9625 6.47102 13.3376 7.64715 13.5508 numMergedOcc 0
16 mol 288 unq 1 iso 0 dist 7.90634 8.50508 5.27724 7.78656 7.51649 10.9625 6.47102 10.0327 7.64715 13.5508 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 7.75212 8.50508 11.7739 7.78656 5.10813 10.9625 6.47102 13.3376 7.64715 13.5508 numMergedOcc 0
18 mol 289 unq 1 iso 0 dist 7.90634 8.50508 5.27724 7.78656 7.51649 10.9625 6.47102 10.0327 7.64715 13.5508 numMergedOcc 0
