0 mol 7 unq 0 iso 0 dist 7.11539 15.5773 9.97624 12.166 10.1959 7.45262 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.11539 15.5773 9.97624 17.0153 13.9514 6.96586 numMergedOcc 0
2 mol 105 unq 0 iso 0 dist 6.09256 5.03194 5.03173 8.5972 4.22355 7.20953 numMergedOcc 0
3 mol 105 unq 1 iso 0 dist 8.40598 6.10266 5.03173 7.29506 4.22355 7.20953 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 8.55826 18.0914 9.83981 18.2991 11.4429 8.11094 numMergedOcc 0
5 mol 128 unq 0 iso 0 dist 9.05678 5.53962 7.75012 9.47172 10.9902 9.89462 numMergedOcc 0
6 mol 128 unq 1 iso 0 dist 8.73383 5.53962 6.98158 9.47172 4.68499 9.89462 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 7.7461 8.88349 6.90634 9.64516 6.85776 7.62145 numMergedOcc 0
8 mol 146 unq 0 iso 0 dist 6.47434 5.03111 6.50043 12.0867 7.20408 8.68349 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 8.75305 12.3219 7.30946 16.16 8.40261 7.04913 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 6.69487 6.66039 9.6096 11.4227 10.3886 6.39981 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 8.14167 13.5257 6.64779 17.4659 9.43677 7.54706 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 8.90567 4.98086 6.32777 14.4106 11.1881 9.52987 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 9.2933 14.0045 5.97685 14.5566 6.12563 5.49808 numMergedOcc 0
14 mol 181 unq 2 iso 0 dist 9.2933 17.8726 8.9289 14.5566 6.12563 7.96291 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 5.82124 10.1922 7.69296 9.20514 4.23527 7.39624 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 8.31236 11.0815 7.69296 12.3178 4.23527 7.39624 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.49129 15.0682 6.87131 10.9992 4.77308 9.42618 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 6.80544 15.0682 9.69818 10.9992 10.2777 9.42618 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 8.87182 4.81796 7.02079 9.02899 12.6361 8.8827 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 5.95622 4.81796 5.88802 9.02899 4.04521 8.8827 numMergedOcc 0
21 mol 272 unq 0 iso 0 dist 9.30214 4.62994 9.24417 10.5331 14.2062 6.98048 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 8.83491 13.2599 8.85779 16.5044 9.76492 6.94131 numMergedOcc 0
23 mol 273 unq 1 iso 0 dist 8.83491 13.2599 8.85779 18.7759 13.6188 9.84628 numMergedOcc 0
24 mol 273 unq 2 iso 0 dist 9.02711 10.9195 8.85779 16.1254 9.76492 6.94131 numMergedOcc 0
25 mol 273 unq 3 iso 0 dist 9.02711 10.9195 8.85779 19.7724 13.6188 9.84628 numMergedOcc 0
