0 mol 20 unq 0 iso 0 dist 9.44151 6.81416 6.38533 7.5037 7.11633 9.47968 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.40392 8.15652 4.33963 10.9024 9.54519 8.70141 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.36524 8.8717 14.0576 6.87212 14.0782 9.69215 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 8.23258 5.85932 5.3502 7.16724 11.6912 9.77392 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.9651 5.94459 8.53692 6.51886 11.5623 5.74389 numMergedOcc 0
5 mol 74 unq 0 iso 0 dist 9.32783 6.2442 4.79817 5.11539 11.1604 9.43699 numMergedOcc 0
6 mol 74 unq 1 iso 0 dist 9.32783 6.2442 4.79817 5.6967 9.99155 5.23115 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.96446 7.05954 5.69731 5.27016 8.4545 8.95651 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 6.70686 7.05954 4.14907 5.27016 7.01176 8.95651 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 6.34542 6.90574 6.39411 4.51896 10.7342 9.82548 numMergedOcc 0
10 mol 128 unq 0 iso 0 dist 8.3127 7.03633 4.81686 3.56535 8.01677 6.17362 numMergedOcc 0
11 mol 128 unq 1 iso 0 dist 8.3127 7.03633 4.81686 9.33619 10.903 6.4416 numMergedOcc 0
12 mol 128 unq 2 iso 0 dist 8.3127 7.03633 4.81686 8.7862 11.6308 6.91935 numMergedOcc 0
13 mol 154 unq 0 iso 0 dist 6.44195 6.03116 6.45768 9.95968 14.212 9.2042 numMergedOcc 0
14 mol 154 unq 1 iso 0 dist 7.34207 6.03116 6.55507 9.95968 6.23399 9.2042 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 7.9895 6.6276 6.44546 4.88159 10.5599 9.17387 numMergedOcc 0
16 mol 167 unq 1 iso 0 dist 6.53913 6.6276 5.48292 4.88159 5.59806 9.17387 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 8.14464 6.06105 9.4364 11.8099 18.1296 9.65075 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 9.93754 6.06105 10.6484 11.8099 12.2756 9.65075 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 8.95071 9.33359 7.00028 9.48296 5.66569 8.38439 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 7.77366 6.96229 5.51666 7.63505 11.0518 8.06435 numMergedOcc 0
21 mol 252 unq 0 iso 0 dist 6.17985 8.62351 5.89666 14.0369 13.1438 9.81593 numMergedOcc 0
22 mol 252 unq 1 iso 0 dist 6.17985 8.62351 5.89666 13.2459 12.98 9.78248 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 9.2067 8.43941 5.27959 5.17102 11.4077 8.15795 numMergedOcc 0
24 mol 258 unq 1 iso 0 dist 9.16078 8.43941 8.25921 5.17102 12.7091 8.15795 numMergedOcc 0
25 mol 280 unq 0 iso 0 dist 6.94723 7.53074 5.76687 6.49238 10.6395 7.10354 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 7.95849 9.79154 6.7501 4.91435 7.26542 9.60904 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 7.95849 9.79154 6.7501 4.91435 7.26542 9.60904 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 7.95849 9.79154 6.7501 4.91435 7.26542 9.60904 numMergedOcc 0
29 mol 294 unq 0 iso 0 dist 7.77765 5.78275 12.0308 14.2497 18.1493 9.2542 numMergedOcc 0
