0 mol 0 unq 0 iso 0 dist 9.23213 8.81979 9.14029 5.24778 8.34244 12.5479 12.9149 8.66548 16.8764 8.73015 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.36807 7.31201 6.57017 13.8829 9.97624 13.6379 13.156 8.81608 14.144 5.5683 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 7.45237 7.33969 4.85203 7.401 6.47855 6.24515 9.26784 8.94353 12.8759 10.5824 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 7.45237 7.33969 4.85203 7.401 6.47855 6.24515 10.2083 7.30265 8.98219 3.91611 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.19682 8.97793 5.67347 6.45686 7.03226 11.1148 15.4159 9.4866 13.9204 10.1364 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 7.64585 9.66954 12.0796 6.40494 7.52142 14.9181 6.95773 7.65255 10.8109 6.44969 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 7.44174 9.38288 11.6138 10.314 7.26955 12.8541 12.4621 6.55202 18.1654 10.3622 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 7.44174 9.38288 11.6138 10.314 7.26955 12.8541 6.20019 9.08536 12.4009 14.9264 numMergedOcc 0
8 mol 119 unq 2 iso 0 dist 7.44174 6.19042 8.58342 10.314 7.26955 13.2572 12.4621 6.55202 14.4956 10.3622 numMergedOcc 0
9 mol 119 unq 3 iso 0 dist 7.44174 6.19042 8.58342 10.314 7.26955 13.2572 6.20019 9.08536 6.13374 14.9264 numMergedOcc 0
10 mol 194 unq 0 iso 0 dist 5.48258 6.15769 7.46053 7.11753 8.52969 12.9874 4.66791 7.10155 9.48418 7.41775 numMergedOcc 0
11 mol 194 unq 1 iso 0 dist 5.48258 6.15769 7.46053 7.11753 8.52969 12.9874 5.97754 6.11135 6.54481 11.4789 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 6.95902 9.62609 8.55671 9.72615 7.57454 14.0608 4.69247 7.79951 10.4959 12.8337 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 9.5707 7.85175 5.32617 10.0059 7.43663 10.0212 3.95629 8.27411 7.36208 11.1693 numMergedOcc 0
14 mol 234 unq 1 iso 0 dist 9.5707 7.85175 5.32617 10.0059 7.43663 10.0212 15.9732 6.96257 9.73255 10.7351 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 8.09066 8.14172 10.9258 12.2874 8.09718 8.90076 6.13368 8.69525 13.8875 15.3328 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 8.09066 8.14172 10.9258 7.11984 6.73446 6.62002 6.13368 8.69525 13.8875 10.3346 numMergedOcc 0
17 mol 238 unq 2 iso 0 dist 7.2766 6.77463 10.9258 10.4017 8.09718 8.90076 10.0605 8.69525 13.8875 15.3328 numMergedOcc 0
18 mol 238 unq 3 iso 0 dist 7.2766 6.77463 10.9258 7.95232 6.73446 6.62002 10.0605 8.69525 13.8875 10.3346 numMergedOcc 0
