0 mol 5 unq 0 iso 0 dist 8.70824 5.2392 11.3755 4.42081 8.97274 9.22027 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.93404 5.2392 5.90479 4.42081 7.5815 9.22027 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 6.70655 5.2392 4.59167 4.42081 10.8072 9.22027 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.41861 6.63973 6.1999 12.8806 10.2474 9.08825 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 5.55798 8.59739 5.71097 3.45432 7.318 8.51259 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 5.74058 5.82945 6.5713 9.25976 13.3329 7.5573 numMergedOcc 0
6 mol 195 unq 0 iso 0 dist 9.35664 9.48766 6.04748 6.61517 6.65077 6.396 numMergedOcc 0
7 mol 197 unq 0 iso 0 dist 7.32228 6.0033 6.57766 10.9673 11.2587 6.69042 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 9.85777 6.41148 6.16492 6.10058 11.034 5.03818 numMergedOcc 0
9 mol 205 unq 1 iso 0 dist 8.47833 6.41148 10.1222 6.10058 7.53734 5.03818 numMergedOcc 0
10 mol 205 unq 2 iso 0 dist 5.05912 6.41148 9.99561 6.10058 9.79826 5.03818 numMergedOcc 0
11 mol 205 unq 3 iso 0 dist 5.47586 5.06713 10.1222 3.50446 7.53734 5.03818 numMergedOcc 0
12 mol 205 unq 4 iso 0 dist 5.47586 8.69512 10.4922 3.50446 7.53734 6.40171 numMergedOcc 0
13 mol 205 unq 5 iso 0 dist 6.60429 5.06713 9.99561 3.50446 9.79826 5.03818 numMergedOcc 0
14 mol 205 unq 6 iso 0 dist 6.60429 8.69512 15.2328 3.50446 9.79826 6.40171 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 4.87053 8.86886 6.4817 4.91709 7.99441 8.14294 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 4.87053 8.86886 6.4817 5.96186 6.71817 5.72 numMergedOcc 0
17 mol 222 unq 2 iso 0 dist 4.87053 8.86886 6.4817 9.55743 8.41524 6.84052 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 9.44671 5.76164 7.87864 4.98419 14.3797 9.01338 numMergedOcc 0
19 mol 233 unq 1 iso 0 dist 7.21531 5.76164 4.74962 4.98419 9.31086 9.01338 numMergedOcc 0
20 mol 233 unq 2 iso 0 dist 8.01777 8.7831 12.6648 3.98113 11.2355 9.01338 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 5.83514 6.96382 4.70535 3.68226 5.52788 4.66186 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 6.91029 8.89714 9.23419 12.2057 11.7246 9.02537 numMergedOcc 0
