0 mol 5 unq 0 iso 0 dist 8.70824 4.42081 8.97274 5.2392 11.3755 9.22027 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.93404 4.42081 7.5815 5.2392 5.90479 9.22027 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 9.99467 8.03211 9.78134 9.5115 11.1943 5.09702 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 7.94701 5.07389 5.63499 10.47 7.73958 5.40489 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.33989 6.69911 6.55112 14.5265 6.38237 9.59729 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 8.57953 3.94216 6.55112 13.12 6.38237 9.59729 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 5.55798 10.0025 8.26763 9.55191 4.0291 8.64934 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 5.55798 6.35003 6.30814 9.55191 4.0291 8.7515 numMergedOcc 0
8 mol 79 unq 2 iso 0 dist 5.55798 3.45432 7.318 8.59739 5.71097 8.51259 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 8.99759 8.52805 9.8896 10.9982 8.2382 5.42044 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 5.81553 3.82552 6.6536 9.58064 8.8974 6.96745 numMergedOcc 0
11 mol 157 unq 0 iso 0 dist 8.78412 12.5289 6.07906 11.5255 5.43167 8.40821 numMergedOcc 0
12 mol 157 unq 1 iso 0 dist 8.78412 11.4935 8.72717 11.5255 5.43167 9.86925 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 8.80952 15.1374 9.1854 12.5347 5.47558 9.10671 numMergedOcc 0
14 mol 170 unq 0 iso 0 dist 9.05865 10.2179 9.66676 12.5742 5.03109 8.75024 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 5.13534 4.76079 5.97971 11.1594 8.70425 9.92831 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 9.35664 14.1853 9.20541 21.1579 14.0091 8.22795 numMergedOcc 0
17 mol 195 unq 1 iso 0 dist 9.35664 6.61517 6.65077 9.48766 6.04748 6.396 numMergedOcc 0
18 mol 195 unq 2 iso 0 dist 9.04342 8.79306 8.84149 10.3127 4.3166 6.396 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 5.81277 11.8763 9.79826 10.867 9.99561 5.03818 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 5.81277 11.8763 9.79826 17.881 15.2328 6.40171 numMergedOcc 0
21 mol 205 unq 2 iso 0 dist 8.47833 6.10058 7.53734 6.41148 10.1222 5.03818 numMergedOcc 0
22 mol 205 unq 3 iso 0 dist 8.47833 6.10058 7.53734 12.239 10.4922 6.40171 numMergedOcc 0
23 mol 205 unq 4 iso 0 dist 5.05912 6.10058 9.79826 6.41148 9.99561 5.03818 numMergedOcc 0
24 mol 205 unq 5 iso 0 dist 5.05912 6.10058 9.79826 12.239 15.2328 6.40171 numMergedOcc 0
25 mol 205 unq 6 iso 0 dist 5.47586 3.50446 7.53734 5.06713 10.1222 5.03818 numMergedOcc 0
26 mol 205 unq 7 iso 0 dist 5.47586 3.50446 7.53734 8.69512 10.4922 6.40171 numMergedOcc 0
27 mol 205 unq 8 iso 0 dist 6.60429 3.50446 9.79826 5.06713 9.99561 5.03818 numMergedOcc 0
28 mol 205 unq 9 iso 0 dist 6.60429 3.50446 9.79826 8.69512 15.2328 6.40171 numMergedOcc 0
29 mol 222 unq 0 iso 0 dist 4.87053 4.91709 7.99441 8.86886 6.4817 8.14294 numMergedOcc 0
30 mol 222 unq 1 iso 0 dist 4.87053 5.96186 6.71817 8.86886 6.4817 5.72 numMergedOcc 0
31 mol 222 unq 2 iso 0 dist 4.87053 9.55743 8.41524 8.86886 6.4817 6.84052 numMergedOcc 0
32 mol 222 unq 3 iso 0 dist 4.87053 9.55743 8.41524 12.4867 8.05936 9.58086 numMergedOcc 0
33 mol 225 unq 0 iso 0 dist 6.97662 9.92088 8.69052 15.1504 12.7959 6.46405 numMergedOcc 0
34 mol 238 unq 0 iso 0 dist 5.83514 3.68226 5.52788 6.96382 4.70535 4.66186 numMergedOcc 0
