0 mol 45 unq 0 iso 0 dist 8.43515 6.47205 6.99408 12.9257 9.22921 7.61402 numMergedOcc 0
1 mol 75 unq 0 iso 0 dist 8.70094 8.67697 6.33365 15.4551 8.72784 7.49283 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.24378 11.2646 8.97793 12.0571 6.71804 8.35595 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.24378 9.43349 8.19682 12.0571 6.71804 6.22513 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 6.37427 10.3152 6.87861 9.35855 4.12752 9.68866 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 6.61066 10.3807 6.50039 17.5254 11.6346 9.68866 numMergedOcc 0
6 mol 173 unq 0 iso 0 dist 9.72828 6.76195 6.98095 8.82137 9.29369 9.13913 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 9.65951 10.8926 5.90931 12.4206 5.43761 5.37579 numMergedOcc 0
8 mol 204 unq 1 iso 0 dist 9.14829 5.63477 5.90931 10.0261 5.43761 5.37579 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 9.05754 5.53308 6.99002 13.6501 9.20027 8.57161 numMergedOcc 0
10 mol 228 unq 0 iso 0 dist 9.51602 5.55391 7.65132 9.79674 6.03966 8.04854 numMergedOcc 0
11 mol 228 unq 1 iso 0 dist 9.46214 5.86537 7.94506 9.82472 6.25423 8.08612 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 9.94587 12.3467 6.91569 15.5262 6.53984 5.72415 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 9.75753 12.2787 7.19465 15.502 7.07333 6.52138 numMergedOcc 0
14 mol 257 unq 0 iso 0 dist 6.50405 5.02339 7.14834 10.4069 6.64096 7.48361 numMergedOcc 0
