0 mol 21 unq 0 iso 0 dist 5.0018 7.30688 8.64046 9.3814 7.39438 13.5668 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 5.0018 6.70786 9.1215 9.3814 7.39438 15.4479 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 5.0018 8.16395 9.60455 9.3814 7.39438 16.5913 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 7.03174 7.82815 9.74845 5.62472 5.9844 10.0077 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 9.36759 9.04117 4.03744 14.6904 9.07906 12.9128 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 9.36759 9.04117 4.03744 12.0121 8.75567 11.6298 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 5.0553 6.34215 4.03744 11.8429 9.07906 12.9128 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 5.0553 6.34215 4.03744 5.8542 8.75567 11.6298 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 9.00217 8.52421 6.8245 14.94 9.18809 15.8762 numMergedOcc 0
9 mol 107 unq 0 iso 0 dist 6.99676 9.68222 8.65482 13.5052 7.02709 14.5329 numMergedOcc 0
10 mol 107 unq 1 iso 0 dist 6.99676 8.28321 6.54199 13.5052 7.02709 10.3757 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 9.87656 9.21757 3.90634 14.7987 8.86966 12.3868 numMergedOcc 0
12 mol 152 unq 1 iso 0 dist 9.87656 9.21757 3.90634 10.8051 5.7527 9.37904 numMergedOcc 0
13 mol 152 unq 2 iso 0 dist 5.35463 6.75471 3.90634 11.7248 8.86966 12.3868 numMergedOcc 0
14 mol 152 unq 3 iso 0 dist 5.35463 6.75471 3.90634 6.4987 5.7527 9.37904 numMergedOcc 0
15 mol 158 unq 0 iso 0 dist 7.41387 9.53944 3.54696 4.80775 9.53821 11.5862 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 5.84716 5.27578 4.4877 7.82249 9.37545 9.3498 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 5.84716 5.27578 4.4877 9.09826 6.02579 7.05695 numMergedOcc 0
18 mol 186 unq 2 iso 0 dist 5.88987 8.25953 4.4877 5.47219 9.37545 9.3498 numMergedOcc 0
19 mol 186 unq 3 iso 0 dist 5.88987 8.25953 4.4877 6.51869 6.02579 7.05695 numMergedOcc 0
20 mol 192 unq 0 iso 0 dist 5.35691 5.08603 8.65211 9.43043 8.91445 14.5163 numMergedOcc 0
21 mol 192 unq 1 iso 0 dist 5.35691 9.30889 8.28507 9.43043 8.91445 14.6825 numMergedOcc 0
22 mol 192 unq 2 iso 0 dist 9.99252 9.63224 9.64278 6.34098 8.63044 9.78634 numMergedOcc 0
23 mol 192 unq 3 iso 0 dist 9.99252 6.98794 10.8255 6.34098 8.63044 5.64942 numMergedOcc 0
24 mol 205 unq 0 iso 0 dist 9.49617 6.50586 8.16419 13.7273 7.23959 14.6064 numMergedOcc 0
25 mol 205 unq 1 iso 0 dist 9.15508 6.75579 5.19623 4.25942 7.23959 6.52816 numMergedOcc 0
26 mol 210 unq 0 iso 0 dist 5.86875 8.25288 3.61565 8.99603 5.62219 8.63693 numMergedOcc 0
27 mol 224 unq 0 iso 0 dist 9.55911 5.36326 9.06907 4.55824 7.80754 8.08349 numMergedOcc 0
28 mol 282 unq 0 iso 0 dist 8.64115 6.00439 6.3041 14.9374 8.76788 14.6216 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 6.69313 5.7547 4.24789 11.2636 8.25636 12.138 numMergedOcc 0
