0 mol 12 unq 0 iso 0 dist 6.91627 5.76006 7.18195 6.62201 9.79847 11.4552 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 5.29367 5.272 5.56136 6.90794 9.37435 11.9282 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.07937 5.272 6.58799 15.1234 9.63803 15.8324 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 8.61226 8.51968 9.80682 5.38977 5.14358 9.37602 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 8.61226 8.51968 9.80682 6.57029 7.3557 12.6852 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 5.35101 6.89262 7.7624 7.30921 8.85156 13.5617 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 5.35101 7.93406 7.63046 7.30921 8.85156 8.63912 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 8.68381 6.50646 7.7624 12.0249 8.85156 13.5617 numMergedOcc 0
8 mol 108 unq 0 iso 0 dist 8.69068 8.84888 14.2308 8.58741 9.14068 13.7196 numMergedOcc 0
9 mol 108 unq 1 iso 0 dist 8.89997 9.89763 6.94601 3.94147 7.90433 11.1444 numMergedOcc 0
10 mol 108 unq 2 iso 0 dist 8.89997 8.49918 5.53105 3.94147 7.90433 5.60118 numMergedOcc 0
11 mol 226 unq 0 iso 0 dist 6.17825 4.61854 5.14305 11.725 9.71835 13.9278 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 9.49046 8.31695 9.75072 11.9355 8.7831 16.2909 numMergedOcc 0
13 mol 233 unq 1 iso 0 dist 9.49046 8.31695 9.75072 14.1168 9.61071 18.3574 numMergedOcc 0
14 mol 233 unq 2 iso 0 dist 9.49046 8.31695 9.75072 11.3928 7.1229 15.3141 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 5.92025 6.02845 5.972 14.3613 9.94117 15.867 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 5.92025 9.35599 10.9042 14.3613 9.94117 20.6484 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 6.84088 5.62744 7.04644 3.45727 7.63381 7.69491 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 6.84088 7.76984 4.99161 3.45727 7.63381 6.64008 numMergedOcc 0
19 mol 256 unq 0 iso 0 dist 9.36652 6.07677 8.22925 4.80469 7.23526 8.89351 numMergedOcc 0
20 mol 256 unq 1 iso 0 dist 7.54613 7.56605 8.22925 4.07811 7.23526 8.89351 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 6.86805 9.84057 7.00525 6.11441 6.22195 9.0208 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 6.86805 7.87939 10.8888 6.11441 6.22195 13.5799 numMergedOcc 0
