0 mol 25 unq 0 iso 0 dist 9.26381 9.46319 5.30126 6.74726 8.88413 6.22122 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 9.26381 9.46319 5.30126 6.61953 9.87281 12.8488 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 9.26381 9.46319 5.30126 5.18181 7.63928 10.5677 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 5.29367 7.10804 6.90338 4.87741 6.89136 11.3555 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 8.07937 7.10804 5.29322 14.9314 6.88695 10.9309 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 6.42206 9.43688 4.54484 4.76147 6.88695 7.51406 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 6.42206 8.64424 5.29322 4.76147 6.88695 10.9309 numMergedOcc 0
7 mol 26 unq 4 iso 0 dist 9.66602 7.04006 4.54484 5.93227 6.88695 7.51406 numMergedOcc 0
8 mol 30 unq 0 iso 0 dist 5.90481 9.46542 5.54786 6.67111 6.88974 7.47342 numMergedOcc 0
9 mol 30 unq 1 iso 0 dist 6.30807 9.46542 6.57228 6.67111 5.5814 7.47342 numMergedOcc 0
10 mol 44 unq 0 iso 0 dist 9.16551 7.40218 5.73343 5.68567 7.78905 9.74935 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 8.87505 7.50959 5.76927 8.50937 5.49877 9.77934 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 5.7232 7.55581 12.974 8.76089 9.50322 10.1767 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 5.7232 7.55581 12.974 6.80087 5.82404 11.6202 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 7.76856 5.15834 11.8927 11.3653 8.1088 16.1859 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 5.30132 8.52655 8.34289 11.373 9.99314 17.9531 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 7.9801 9.82279 11.495 12.195 7.117 18.4368 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.61428 9.27557 6.21166 5.77573 9.13537 6.06422 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 7.79013 4.66398 5.19565 10.2076 9.10633 10.4415 numMergedOcc 0
19 mol 241 unq 1 iso 0 dist 9.33399 9.05448 5.19565 10.1832 9.10633 10.4415 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 8.93002 5.80603 11.3649 5.56656 8.06771 10.9903 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 8.09021 8.9413 10.5191 4.75685 9.772 5.3051 numMergedOcc 0
