0 mol 2 unq 0 iso 0 dist 8.5893 4.00237 5.74846 9.39095 7.16799 7.2721 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 8.29974 4.00237 4.93584 9.39095 4.03902 7.2721 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 5.88525 6.42073 5.74846 11.6703 7.16799 7.2721 numMergedOcc 0
3 mol 2 unq 3 iso 0 dist 8.73586 6.42073 4.93584 11.6703 4.03902 7.2721 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 7.68085 10.7036 8.65986 16.7374 11.253 7.47395 numMergedOcc 0
5 mol 20 unq 1 iso 0 dist 8.45034 10.7036 9.74724 16.7374 12.4229 7.47395 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.739 14.5346 9.86479 22.4463 14.7216 9.07629 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 9.739 14.5346 9.86479 21.0639 16.1736 8.61143 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 9.27456 7.41484 7.67463 9.86038 7.59896 4.18248 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.43487 3.74516 8.46167 7.96893 4.62493 5.31126 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 9.43487 3.74516 8.46167 10.3461 6.47997 7.16619 numMergedOcc 0
11 mol 113 unq 2 iso 0 dist 9.43487 7.32784 6.13175 7.96893 4.62493 4.49669 numMergedOcc 0
12 mol 113 unq 3 iso 0 dist 9.43487 7.32784 6.13175 10.3461 6.47997 5.88896 numMergedOcc 0
13 mol 113 unq 4 iso 0 dist 9.43487 8.46561 4.34107 7.96893 4.62493 6.00221 numMergedOcc 0
14 mol 113 unq 5 iso 0 dist 9.97052 11.4966 8.46167 12.376 4.62493 5.31126 numMergedOcc 0
15 mol 113 unq 6 iso 0 dist 9.97052 11.4966 8.46167 15.0956 6.47997 7.16619 numMergedOcc 0
16 mol 113 unq 7 iso 0 dist 9.97052 11.9142 6.13175 12.376 4.62493 4.49669 numMergedOcc 0
17 mol 113 unq 8 iso 0 dist 9.97052 11.9142 6.13175 15.0956 6.47997 5.88896 numMergedOcc 0
18 mol 113 unq 9 iso 0 dist 9.97052 9.75283 4.34107 12.376 4.62493 6.00221 numMergedOcc 0
19 mol 113 unq 10 iso 0 dist 7.3324 13.8072 8.46167 10.1843 4.62493 5.31126 numMergedOcc 0
20 mol 113 unq 11 iso 0 dist 7.3324 13.8072 8.46167 10.8312 6.47997 7.16619 numMergedOcc 0
21 mol 113 unq 12 iso 0 dist 7.3324 8.67805 6.13175 10.1843 4.62493 4.49669 numMergedOcc 0
22 mol 113 unq 13 iso 0 dist 7.3324 8.67805 6.13175 10.8312 6.47997 5.88896 numMergedOcc 0
23 mol 113 unq 14 iso 0 dist 7.3324 6.03962 4.34107 10.1843 4.62493 6.00221 numMergedOcc 0
24 mol 184 unq 0 iso 0 dist 5.81126 3.62053 6.79615 7.65214 4.06997 9.21536 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 9.28645 6.9328 9.57433 12.2511 12.4019 9.54529 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 8.9785 3.90226 9.57433 11.5517 12.4019 9.54529 numMergedOcc 0
27 mol 230 unq 0 iso 0 dist 8.74988 6.2863 8.89873 6.99256 3.28958 9.47092 numMergedOcc 0
28 mol 254 unq 0 iso 0 dist 8.83523 5.81468 5.44351 7.89302 5.14008 7.85841 numMergedOcc 0
29 mol 254 unq 1 iso 0 dist 8.83523 8.51317 6.34051 7.89302 5.14008 9.20109 numMergedOcc 0
30 mol 266 unq 0 iso 0 dist 7.01175 12.5701 8.53393 19.4977 13.7573 7.8598 numMergedOcc 0
31 mol 266 unq 1 iso 0 dist 7.01175 12.5701 8.53393 12.1955 10.0357 8.25286 numMergedOcc 0
32 mol 266 unq 2 iso 0 dist 7.01175 12.5076 7.24165 19.4977 13.7573 7.80711 numMergedOcc 0
33 mol 266 unq 3 iso 0 dist 7.01175 12.5076 7.24165 12.1955 10.0357 9.9965 numMergedOcc 0
34 mol 266 unq 4 iso 0 dist 7.50074 15.7607 8.53393 21.1782 13.7573 7.8598 numMergedOcc 0
35 mol 266 unq 5 iso 0 dist 7.50074 15.7607 8.53393 15.7401 10.0357 8.25286 numMergedOcc 0
36 mol 266 unq 6 iso 0 dist 7.50074 14.5235 7.24165 21.1782 13.7573 7.80711 numMergedOcc 0
37 mol 266 unq 7 iso 0 dist 7.50074 14.5235 7.24165 15.7401 10.0357 9.9965 numMergedOcc 0
38 mol 268 unq 0 iso 0 dist 6.9226 3.43113 6.38058 8.6577 6.58875 9.52476 numMergedOcc 0
39 mol 283 unq 0 iso 0 dist 7.81415 6.35533 9.90494 12.2239 12.6476 7.31132 numMergedOcc 0
