0 mol 5 unq 0 iso 0 dist 8.51616 11.1428 7.74636 8.17911 7.64769 5.31713 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.51616 11.1428 7.74636 11.3339 8.31759 7.84244 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 5.64762 5.48609 8.34817 8.17911 9.70883 13.2371 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 5.64762 5.48609 8.34817 8.37288 9.65565 3.24598 numMergedOcc 0
4 mol 11 unq 0 iso 0 dist 5.34687 9.03724 9.89425 10.2968 6.83186 12.0683 numMergedOcc 0
5 mol 28 unq 0 iso 0 dist 9.41374 5.09941 9.2146 15.0747 8.53424 16.4255 numMergedOcc 0
6 mol 28 unq 1 iso 0 dist 9.41374 5.09941 9.2146 15.2677 7.08766 16.0765 numMergedOcc 0
7 mol 28 unq 2 iso 0 dist 9.41374 5.09941 9.2146 12.524 4.82199 13.6412 numMergedOcc 0
8 mol 34 unq 0 iso 0 dist 8.54309 8.15476 6.52283 5.3031 4.75881 3.41186 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 7.83023 7.39859 8.67025 7.02956 5.31126 9.59189 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 7.83023 7.39859 8.67025 5.49918 4.49669 10.1118 numMergedOcc 0
11 mol 113 unq 2 iso 0 dist 7.83023 7.39859 8.67025 4.25595 6.00221 8.19901 numMergedOcc 0
12 mol 169 unq 0 iso 0 dist 7.95377 7.66151 8.6961 6.57889 5.10589 9.60496 numMergedOcc 0
13 mol 169 unq 1 iso 0 dist 7.95377 7.66151 8.6961 5.83343 4.63336 10.5251 numMergedOcc 0
14 mol 169 unq 2 iso 0 dist 7.95377 7.66151 8.6961 4.39759 6.10715 8.67112 numMergedOcc 0
15 mol 169 unq 3 iso 0 dist 6.7265 8.31869 9.06172 7.73114 6.96715 13.5169 numMergedOcc 0
16 mol 169 unq 4 iso 0 dist 6.7265 10.6459 8.93091 7.73114 6.96715 14.673 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 6.90148 12.9388 8.92135 6.02214 7.25595 14.4913 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 6.90148 12.9388 8.92135 12.6188 9.94825 5.43612 numMergedOcc 0
19 mol 186 unq 2 iso 0 dist 6.30614 8.81573 8.92135 6.71348 7.25595 14.4913 numMergedOcc 0
20 mol 186 unq 3 iso 0 dist 6.30614 8.81573 8.92135 6.11153 9.94825 5.43612 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 6.3194 6.56919 5.6417 12.4828 7.85841 8.8967 numMergedOcc 0
22 mol 254 unq 1 iso 0 dist 6.3194 6.56919 5.6417 13.1705 9.20109 10.929 numMergedOcc 0
23 mol 254 unq 2 iso 0 dist 6.3194 6.2909 7.42831 12.4828 7.85841 9.42679 numMergedOcc 0
24 mol 254 unq 3 iso 0 dist 6.3194 6.2909 7.42831 13.1705 9.20109 10.706 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 6.82552 10.2133 7.73438 4.0507 5.88958 10.5542 numMergedOcc 0
26 mol 285 unq 1 iso 0 dist 6.82552 10.2133 7.73438 8.91965 7.78121 12.5361 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 8.98138 6.71664 4.93516 10.0104 4.68668 3.66473 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 8.98138 6.71664 4.93516 10.0104 4.68668 3.66473 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 8.98138 6.71664 4.93516 10.0104 4.68668 3.66473 numMergedOcc 0
