0 mol 37 unq 0 iso 0 dist 6.85013 5.30801 9.70445 15.3094 9.64602 15.6099 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 7.36132 9.38745 9.0081 12.0694 8.68888 9.66129 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.60665 6.15635 5.25083 8.85854 8.35595 4.35757 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.60665 6.15635 5.25083 9.75591 6.22513 6.55474 numMergedOcc 0
4 mol 76 unq 2 iso 0 dist 7.60665 5.07989 8.7835 8.85854 8.35595 6.35895 numMergedOcc 0
5 mol 76 unq 3 iso 0 dist 7.60665 5.07989 8.7835 9.75591 6.22513 10.0405 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 5.09285 7.22087 6.56066 5.03825 8.90311 7.99224 numMergedOcc 0
7 mol 140 unq 0 iso 0 dist 9.68237 8.63563 8.6371 11.1349 6.29125 11.324 numMergedOcc 0
8 mol 151 unq 0 iso 0 dist 8.7814 5.81788 8.70668 13.7772 7.48309 11.3404 numMergedOcc 0
9 mol 153 unq 0 iso 0 dist 9.2733 6.77929 9.47241 10.115 7.63379 4.82179 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 7.16289 7.95074 9.17333 10.9769 9.39643 6.17464 numMergedOcc 0
11 mol 154 unq 1 iso 0 dist 9.3164 4.57254 9.17333 5.33656 9.39643 6.17464 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 6.74945 11.5022 7.10646 4.75901 8.45955 10.1962 numMergedOcc 0
13 mol 220 unq 1 iso 0 dist 6.74945 11.5022 7.10646 9.80096 7.64168 4.02873 numMergedOcc 0
14 mol 220 unq 2 iso 0 dist 5.15585 6.92811 7.10646 6.61753 8.45955 10.1962 numMergedOcc 0
15 mol 220 unq 3 iso 0 dist 5.15585 6.92811 7.10646 5.13854 7.64168 4.02873 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 9.94974 7.10871 5.15432 14.961 8.46687 9.40437 numMergedOcc 0
17 mol 279 unq 1 iso 0 dist 9.94974 6.21202 8.2375 14.961 8.46687 10.9253 numMergedOcc 0
18 mol 279 unq 2 iso 0 dist 9.94974 10.7671 9.23951 14.961 8.46687 6.4164 numMergedOcc 0
19 mol 279 unq 3 iso 0 dist 4.54596 5.69688 5.15432 5.2006 8.46687 9.40437 numMergedOcc 0
20 mol 279 unq 4 iso 0 dist 4.54596 10.1983 8.2375 5.2006 8.46687 10.9253 numMergedOcc 0
21 mol 279 unq 5 iso 0 dist 4.54596 8.2301 9.23951 5.2006 8.46687 6.4164 numMergedOcc 0
22 mol 279 unq 6 iso 0 dist 8.32942 12.6943 5.15432 8.86683 8.46687 9.40437 numMergedOcc 0
23 mol 279 unq 7 iso 0 dist 8.32942 14.9381 8.2375 8.86683 8.46687 10.9253 numMergedOcc 0
24 mol 279 unq 8 iso 0 dist 8.32942 13.6162 9.23951 8.86683 8.46687 6.4164 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 5.84481 4.29335 9.91812 12.6659 8.6173 15.7226 numMergedOcc 0
