0 mol 48 unq 0 iso 0 dist 9.04514 7.50273 8.80801 8.86877 9.87339 7.99399 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 9.23947 3.36421 8.41025 10.8916 6.08338 8.27592 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 9.89353 4.51209 7.70527 10.9252 5.74138 7.4658 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 5.74058 6.44931 7.93346 13.2063 9.47799 9.74763 numMergedOcc 0
4 mol 247 unq 0 iso 0 dist 9.21409 9.83927 6.32156 15.8059 13.1821 9.48468 numMergedOcc 0
5 mol 247 unq 1 iso 0 dist 9.17812 5.40081 6.32156 13.8086 13.1821 9.48468 numMergedOcc 0
6 mol 258 unq 0 iso 0 dist 8.53084 9.04475 9.12231 14.0024 8.11944 8.34471 numMergedOcc 0
7 mol 258 unq 1 iso 0 dist 5.9223 11.6457 9.12231 10.5751 8.11944 8.34471 numMergedOcc 0
8 mol 259 unq 0 iso 0 dist 8.93518 4.77489 9.06386 9.03983 10.7817 9.2772 numMergedOcc 0
9 mol 265 unq 0 iso 0 dist 8.5774 12.963 9.74602 13.3804 5.34511 8.19772 numMergedOcc 0
10 mol 265 unq 1 iso 0 dist 9.94957 4.86847 9.74602 10.5215 5.34511 8.19772 numMergedOcc 0
11 mol 265 unq 2 iso 0 dist 8.01664 9.6804 9.74602 11.3817 5.34511 8.19772 numMergedOcc 0
12 mol 268 unq 0 iso 0 dist 6.62669 5.28119 5.46063 12.8508 7.26866 8.84415 numMergedOcc 0
13 mol 274 unq 0 iso 0 dist 7.8547 5.66978 9.70022 10.81 9.14863 7.59956 numMergedOcc 0
14 mol 274 unq 1 iso 0 dist 7.8547 5.66978 9.70022 12.493 13.9861 8.05503 numMergedOcc 0
15 mol 274 unq 2 iso 0 dist 7.8547 5.66978 9.70022 7.03782 8.48682 5.59151 numMergedOcc 0
16 mol 274 unq 3 iso 0 dist 7.8547 10.88 7.32898 7.03782 8.48682 8.17922 numMergedOcc 0
17 mol 276 unq 0 iso 0 dist 9.51555 10.966 8.26741 15.3301 11.1462 7.35537 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 9.73763 15.5265 9.04167 18.6676 9.95012 5.25218 numMergedOcc 0
19 mol 279 unq 1 iso 0 dist 9.73763 15.5265 9.04167 16.5235 7.10445 8.31465 numMergedOcc 0
20 mol 279 unq 2 iso 0 dist 9.73763 15.5265 9.04167 7.67032 4.8694 7.88102 numMergedOcc 0
