0 mol 10 unq 0 iso 0 dist 5.66059 6.77258 5.59965 8.09253 3.92592 6.18431 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 5.66059 6.77258 5.59965 10.8305 5.53712 9.07726 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 5.99743 5.16967 5.59965 10.7108 4.99208 9.43029 numMergedOcc 0
3 mol 12 unq 0 iso 0 dist 9.44587 7.00815 8.47217 12.9025 5.41989 9.90835 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.7004 6.81961 6.56527 13.415 10.0347 6.7142 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.98874 12.7242 8.29857 17.0116 9.02536 6.03404 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.09041 10.427 8.87742 14.9261 12.2375 9.77084 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 9.09041 10.427 8.87742 15.6541 13.1414 6.5551 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.48678 8.83348 7.36769 6.74197 3.92737 9.25444 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 8.48678 8.83348 7.36769 12.3653 3.94967 9.84703 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 8.48678 14.016 6.88901 6.74197 3.92737 8.46823 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 8.48678 14.016 6.88901 12.3653 3.94967 4.62494 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 7.1754 9.82137 9.5057 15.5204 12.48 6.59691 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 7.03339 5.54999 7.80873 12.3351 8.72143 8.72725 numMergedOcc 0
14 mol 112 unq 1 iso 0 dist 7.03339 5.54999 7.80873 7.77418 5.08111 6.11407 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 6.65725 4.84884 7.54099 9.07247 4.67256 7.58375 numMergedOcc 0
16 mol 192 unq 0 iso 0 dist 9.70629 14.1553 8.26288 18.2169 11.3394 9.40971 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 6.71099 7.46856 9.78181 15.7335 14.876 9.9183 numMergedOcc 0
18 mol 256 unq 0 iso 0 dist 9.31961 12.3321 6.00636 17.7492 9.39697 6.85663 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 8.16005 5.63899 7.16346 9.29783 8.43367 7.85836 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 8.16005 5.63899 7.16346 8.28809 3.78984 6.35532 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 7.88238 13.008 8.20644 22.0372 16.0346 9.26157 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 9.55425 11.7492 8.25485 10.8572 6.56416 7.83214 numMergedOcc 0
