0 mol 68 unq 0 iso 0 dist 5.13951 9.47129 7.89895 15.5312 12.2139 8.23849 numMergedOcc 0
1 mol 68 unq 1 iso 0 dist 5.88852 9.47129 9.54996 15.5312 12.213 8.23849 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 5.98626 6.40513 9.71134 9.07993 8.0249 6.25529 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 5.98626 6.40513 9.71134 8.15853 4.34173 9.74248 numMergedOcc 0
4 mol 152 unq 0 iso 0 dist 9.8167 5.1476 8.72411 14.3933 12.0566 9.3516 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 9.58365 11.7272 9.2828 8.49918 3.44683 7.00443 numMergedOcc 0
6 mol 176 unq 0 iso 0 dist 8.69001 6.06965 5.61752 7.67133 4.78621 7.89418 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 5.94087 6.98632 4.95355 5.86234 3.84531 6.13396 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 8.78286 7.48216 6.93215 9.98717 13.764 8.37216 numMergedOcc 0
9 mol 210 unq 1 iso 0 dist 8.78286 7.48216 6.93215 11.7039 5.64437 5.6524 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 8.81279 14.6666 7.01486 14.1486 5.75214 7.4083 numMergedOcc 0
11 mol 220 unq 1 iso 0 dist 8.81279 15.1244 8.86569 14.1486 5.75214 8.24411 numMergedOcc 0
12 mol 220 unq 2 iso 0 dist 9.57951 11.4142 7.01486 14.7138 5.75214 7.4083 numMergedOcc 0
13 mol 220 unq 3 iso 0 dist 9.57951 12.139 8.86569 14.7138 5.75214 8.24411 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 6.71734 5.94643 9.90442 11.7243 16.8277 7.07461 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 7.71093 5.67613 7.8339 10.0614 4.933 7.30709 numMergedOcc 0
16 mol 268 unq 0 iso 0 dist 9.73322 6.41127 8.38444 14.7466 10.2202 9.7571 numMergedOcc 0
