0 mol 1 unq 0 iso 0 dist 7.59404 7.20594 6.15359 9.60615 5.21705 10.9826 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.4095 9.15143 8.56671 9.60361 8.54246 14.3417 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 7.63261 5.94326 10.0434 9.00899 10.8265 4.25448 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 7.63261 5.94326 10.0434 7.826 13.2709 9.07359 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 8.27424 4.52881 8.70604 6.86391 8.76163 9.37301 numMergedOcc 0
5 mol 44 unq 1 iso 0 dist 6.4519 4.52881 5.23045 6.86391 8.72795 9.37301 numMergedOcc 0
6 mol 46 unq 0 iso 0 dist 8.99557 7.06922 14.0277 9.72136 8.55766 9.59822 numMergedOcc 0
7 mol 46 unq 1 iso 0 dist 8.99557 7.06922 14.0277 4.61355 5.91159 10.3583 numMergedOcc 0
8 mol 53 unq 0 iso 0 dist 8.61714 7.77338 7.88793 7.27048 6.65221 10.8961 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 9.56049 6.21251 9.89759 6.61587 8.60969 9.23738 numMergedOcc 0
10 mol 83 unq 1 iso 0 dist 9.56049 6.21251 9.89759 8.24464 10.3226 6.27705 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 8.60361 6.13194 5.29056 9.43076 11.4521 13.3309 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.75007 4.84604 8.58899 7.09831 3.75291 5.30466 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 6.52227 8.84415 6.83142 7.20083 3.97541 10.4918 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 8.6499 6.81055 5.13979 9.8506 13.5761 8.51158 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 8.75339 6.77966 5.23046 9.91991 13.6344 8.45996 numMergedOcc 0
16 mol 180 unq 0 iso 0 dist 7.36717 9.1144 9.3951 9.80157 4.71622 14.0615 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 8.8495 9.10711 6.72047 7.63908 7.54616 11.7979 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 8.8495 8.94211 4.02883 7.63908 7.54616 9.15903 numMergedOcc 0
19 mol 205 unq 2 iso 0 dist 8.00688 9.10711 8.92874 7.63908 3.69062 11.7979 numMergedOcc 0
20 mol 205 unq 3 iso 0 dist 8.00688 8.94211 8.28418 7.63908 3.69062 9.15903 numMergedOcc 0
21 mol 237 unq 0 iso 0 dist 9.66939 8.81333 4.68717 6.16312 12.3906 11.6072 numMergedOcc 0
22 mol 284 unq 0 iso 0 dist 9.00473 7.71744 5.34977 7.21255 9.60012 7.00626 numMergedOcc 0
23 mol 284 unq 1 iso 0 dist 9.00473 4.70976 4.80547 7.21255 9.60012 6.34668 numMergedOcc 0
