0 mol 41 unq 0 iso 0 dist 8.6783 7.85477 5.31016 12.9999 5.91275 9.18836 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.61209 4.31691 6.66861 8.57528 8.03646 9.89804 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 5.7638 6.96815 6.66861 8.24934 8.03646 9.89804 numMergedOcc 0
3 mol 55 unq 2 iso 0 dist 8.55679 6.96815 6.72084 8.24934 13.0255 9.89804 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 5.59846 4.20309 6.85867 8.54948 5.53481 7.01545 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 7.62621 5.75219 5.51406 8.01351 6.16048 6.93893 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 8.52947 14.4934 7.4518 16.9421 8.97237 7.8962 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 8.84466 16.0131 7.4518 14.0704 8.97237 7.8962 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 7.99121 10.6956 6.66022 18.0246 11.1994 8.12854 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 9.35162 10.2009 9.49761 8.20389 3.93522 6.51968 numMergedOcc 0
10 mol 128 unq 1 iso 0 dist 9.35162 7.34304 6.03154 8.20389 3.93522 7.61237 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 6.28769 8.52762 9.41073 10.2396 7.75436 8.40219 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 9.99743 12.1363 9.51638 8.87968 7.46995 9.31172 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 6.01193 6.3638 9.73592 6.50096 4.69192 9.83883 numMergedOcc 0
14 mol 233 unq 1 iso 0 dist 7.40749 6.52401 9.73592 9.91416 4.69192 9.83883 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 7.02076 12.8127 9.34735 12.1961 9.53082 8.64294 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 8.78758 4.19643 9.21145 9.79758 5.1526 8.30195 numMergedOcc 0
