0 mol 6 unq 0 iso 0 dist 7.76205 5.16051 8.15992 13.0268 9.20957 9.56016 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.85083 12.6167 8.70331 8.83144 5.33785 7.29783 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.6367 5.64505 6.81735 7.72041 4.9947 9.87963 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 9.63946 7.12151 6.81735 14.3004 4.9947 9.87963 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 5.98764 7.13718 4.8983 13.4572 11.9118 7.69222 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 5.98764 7.13718 4.8983 10.4733 10.0644 5.82056 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 5.98764 7.13718 4.8983 9.90039 12.1501 9.09115 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 8.6356 6.30451 7.27275 7.84956 3.62998 9.11547 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 8.6356 6.30451 7.27275 8.57607 8.96713 8.23073 numMergedOcc 0
9 mol 107 unq 0 iso 0 dist 7.09988 4.25808 7.2168 10.9355 5.88785 9.68222 numMergedOcc 0
10 mol 107 unq 1 iso 0 dist 7.09988 4.25808 7.2168 11.1687 8.55732 8.28321 numMergedOcc 0
11 mol 107 unq 2 iso 0 dist 7.73898 9.37941 7.2168 10.4236 5.88785 9.68222 numMergedOcc 0
12 mol 107 unq 3 iso 0 dist 7.73898 9.37941 7.2168 15.2671 8.55732 8.28321 numMergedOcc 0
13 mol 170 unq 0 iso 0 dist 8.56983 10.1859 6.7638 11.7268 3.58196 8.82169 numMergedOcc 0
14 mol 182 unq 0 iso 0 dist 7.12941 6.07603 6.55146 8.5093 3.53123 5.61604 numMergedOcc 0
15 mol 193 unq 0 iso 0 dist 8.29723 5.18783 9.13587 5.06367 9.3899 8.44337 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 9.48763 4.71117 9.16422 12.2406 12.8209 7.75518 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 6.26596 8.09631 9.46274 16.4203 15.9748 8.44407 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 6.26596 8.09631 9.46274 12.3608 10.9698 6.0155 numMergedOcc 0
19 mol 214 unq 2 iso 0 dist 6.26596 8.09631 9.46274 5.56977 5.22858 8.89981 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 8.63808 5.7425 8.99104 8.30771 7.75074 5.99355 numMergedOcc 0
21 mol 253 unq 0 iso 0 dist 7.79803 5.45863 6.74521 9.08259 3.92688 8.59229 numMergedOcc 0
22 mol 253 unq 1 iso 0 dist 7.79803 5.45863 6.74521 10.1882 3.21986 7.33165 numMergedOcc 0
23 mol 253 unq 2 iso 0 dist 7.79803 5.45863 6.74521 8.42325 4.47943 9.66967 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 8.70774 10.1327 4.1545 7.88009 5.9732 9.91103 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 8.70774 10.1327 4.1545 5.80061 3.79766 7.0603 numMergedOcc 0
