0 mol 7 unq 0 iso 0 dist 9.8603 9.30196 7.15434 5.77374 5.70161 6.0323 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 8.609 4.64354 6.83481 13.4305 6.40527 9.72314 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 6.88974 5.54786 7.47342 11.6463 5.39896 9.77521 numMergedOcc 0
3 mol 30 unq 2 iso 0 dist 5.5814 6.57228 7.47342 7.2159 5.39896 9.77521 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.2377 6.46551 6.10011 12.2228 8.04817 7.84699 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.2377 6.46551 6.10011 14.5455 9.76331 8.40844 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 8.2377 6.46551 6.10011 12.578 10.4402 6.99156 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 6.18305 12.2435 8.124 5.58346 5.2774 7.84699 numMergedOcc 0
8 mol 73 unq 4 iso 0 dist 6.18305 12.2435 8.124 9.10386 5.44275 8.40844 numMergedOcc 0
9 mol 73 unq 5 iso 0 dist 6.18305 12.2435 8.124 10.4391 8.0624 6.99156 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 6.40546 9.90172 7.85527 14.3388 11.2951 9.07096 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.58911 7.56512 6.58792 6.13872 5.07895 8.03259 numMergedOcc 0
12 mol 199 unq 0 iso 0 dist 8.30443 4.98653 9.30897 7.16849 4.26752 7.29716 numMergedOcc 0
13 mol 199 unq 1 iso 0 dist 8.30443 4.98653 9.30897 12.9564 12.1142 8.80983 numMergedOcc 0
14 mol 212 unq 0 iso 0 dist 5.87223 12.1126 9.47932 14.4767 9.7586 6.41916 numMergedOcc 0
15 mol 212 unq 1 iso 0 dist 8.062 4.95466 9.47932 7.73701 9.7586 6.41916 numMergedOcc 0
16 mol 212 unq 2 iso 0 dist 8.70011 11.245 9.47932 14.1474 9.7586 6.41916 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 6.9398 6.7488 4.851 6.2441 8.31343 5.98076 numMergedOcc 0
18 mol 219 unq 0 iso 0 dist 4.87446 6.28221 6.8424 9.52151 10.9246 7.98941 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 8.39002 4.61429 9.73411 12.0262 14.3302 8.68767 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 8.39002 11.1139 7.07564 13.2856 5.63485 7.7163 numMergedOcc 0
21 mol 224 unq 2 iso 0 dist 8.39002 11.1139 7.07564 12.9091 4.8786 9.2 numMergedOcc 0
22 mol 224 unq 3 iso 0 dist 9.2053 4.61429 7.75485 12.0262 9.74911 8.68767 numMergedOcc 0
23 mol 224 unq 4 iso 0 dist 9.2053 11.1139 9.11052 13.2856 10.3532 7.7163 numMergedOcc 0
24 mol 224 unq 5 iso 0 dist 9.2053 11.1139 9.11052 12.9091 6.38066 9.2 numMergedOcc 0
25 mol 251 unq 0 iso 0 dist 9.228 6.23285 8.8487 12.3193 6.74706 8.20341 numMergedOcc 0
26 mol 251 unq 1 iso 0 dist 9.228 6.23285 8.8487 12.4814 6.91874 8.65547 numMergedOcc 0
27 mol 251 unq 2 iso 0 dist 7.4878 6.68895 7.54763 12.0914 6.07836 8.84041 numMergedOcc 0
28 mol 252 unq 0 iso 0 dist 6.1197 9.75362 6.41821 8.63848 4.98533 7.74647 numMergedOcc 0
29 mol 256 unq 0 iso 0 dist 7.67598 4.19031 5.98967 9.37687 9.07441 8.11884 numMergedOcc 0
30 mol 265 unq 0 iso 0 dist 9.772 10.5191 5.3051 11.5231 5.11366 5.10595 numMergedOcc 0
31 mol 266 unq 0 iso 0 dist 8.12852 4.55986 9.07043 3.90274 5.73592 6.35457 numMergedOcc 0
32 mol 274 unq 0 iso 0 dist 8.49076 7.64336 6.36173 12.9839 4.54581 9.94705 numMergedOcc 0
33 mol 274 unq 1 iso 0 dist 9.52894 9.82234 8.71129 12.0677 16.0765 8.26695 numMergedOcc 0
34 mol 274 unq 2 iso 0 dist 9.52894 9.82234 8.71129 13.0047 13.1879 5.59151 numMergedOcc 0
35 mol 274 unq 3 iso 0 dist 9.52894 9.82234 8.71129 13.604 5.7745 8.17922 numMergedOcc 0
36 mol 277 unq 0 iso 0 dist 7.88897 5.24499 7.07459 13.9851 12.7283 8.83777 numMergedOcc 0
37 mol 277 unq 1 iso 0 dist 7.88897 5.24499 7.07459 12.4757 13.8339 9.42812 numMergedOcc 0
