0 mol 7 unq 0 iso 0 dist 7.92316 6.24628 5.19202 8.48743 5.95307 8.63198 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.24155 7.66002 11.2819 8.81762 8.58937 6.6768 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 8.24155 7.66002 11.2819 5.32149 6.81904 10.1168 numMergedOcc 0
3 mol 18 unq 2 iso 0 dist 8.24155 6.83177 8.76128 8.81762 8.58937 12.6736 numMergedOcc 0
4 mol 18 unq 3 iso 0 dist 8.24155 6.83177 8.76128 5.32149 6.81904 5.73846 numMergedOcc 0
5 mol 20 unq 0 iso 0 dist 7.33632 9.25342 5.86427 9.44151 5.30679 10.7399 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.25184 6.37408 15.3553 5.9651 9.32604 8.66168 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 9.43167 6.37408 12.1147 5.9651 6.38894 8.66168 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 9.35806 8.86576 3.94942 9.25901 5.05123 7.74462 numMergedOcc 0
9 mol 90 unq 1 iso 0 dist 9.35806 8.86576 3.94942 7.96299 12.0807 11.6072 numMergedOcc 0
10 mol 90 unq 2 iso 0 dist 4.48773 8.86576 8.74347 9.25901 5.51793 7.74462 numMergedOcc 0
11 mol 90 unq 3 iso 0 dist 4.48773 8.86576 8.74347 7.96299 6.1985 11.6072 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 8.58504 8.79798 14.8898 9.96446 11.5195 16.134 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 8.58504 8.79798 14.8898 6.70686 11.5567 13.618 numMergedOcc 0
14 mol 102 unq 0 iso 0 dist 9.2958 8.63253 11.7652 8.84131 9.50884 6.42572 numMergedOcc 0
15 mol 102 unq 1 iso 0 dist 9.2958 5.15752 5.29186 8.84131 9.50884 5.54551 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 9.35411 9.63311 6.05147 6.37528 4.12752 6.31152 numMergedOcc 0
17 mol 115 unq 1 iso 0 dist 9.35411 8.0631 5.97132 6.37528 4.12752 5.56084 numMergedOcc 0
18 mol 115 unq 2 iso 0 dist 9.35411 8.90273 9.6794 6.37528 4.12752 6.98664 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 6.56224 8.07957 4.83663 8.95433 10.4303 6.80292 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 9.04346 7.21359 4.32169 6.0639 8.3612 5.85613 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 9.04346 7.21359 4.32169 6.91355 13.6446 10.0304 numMergedOcc 0
22 mol 195 unq 0 iso 0 dist 8.27131 9.39921 10.3404 4.78641 5.87028 12.0021 numMergedOcc 0
23 mol 195 unq 1 iso 0 dist 8.27131 7.66181 4.67129 4.78641 5.87028 7.95188 numMergedOcc 0
24 mol 230 unq 0 iso 0 dist 9.38925 8.2419 12.0244 6.03738 7.29701 5.45786 numMergedOcc 0
25 mol 230 unq 1 iso 0 dist 8.71717 8.2419 9.92035 6.03738 4.74715 5.45786 numMergedOcc 0
26 mol 231 unq 0 iso 0 dist 9.79495 6.00509 6.5872 6.02527 6.39215 5.3251 numMergedOcc 0
