0 mol 26 unq 0 iso 0 dist 6.32127 7.23962 5.497 9.77186 9.5053 14.3325 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 5.80623 10.1283 7.60283 5.45556 7.45532 14.2471 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 7.24775 3.71754 7.60283 14.2929 7.45532 14.2471 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.7389 11.0222 7.03226 11.5471 9.75201 5.77727 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 7.43804 11.1769 6.0129 12.4403 8.43352 13.6622 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 8.22984 12.1174 7.09065 6.16378 9.5669 10.2428 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 6.6157 7.39527 7.09065 5.69359 9.5669 10.2428 numMergedOcc 0
7 mol 100 unq 2 iso 0 dist 7.37771 5.22124 7.09065 10.1726 9.5669 10.2428 numMergedOcc 0
8 mol 105 unq 0 iso 0 dist 8.60172 6.21149 5.03173 8.60231 7.09806 6.14305 numMergedOcc 0
9 mol 116 unq 0 iso 0 dist 7.85045 4.98814 7.35992 5.83414 8.79367 7.50935 numMergedOcc 0
10 mol 116 unq 1 iso 0 dist 7.85045 9.53721 6.49383 5.83414 8.79367 12.4955 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 9.96946 6.91022 6.90634 15.9537 8.91311 9.52351 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.32254 6.41401 6.87262 5.90381 7.82544 9.24851 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 9.32254 6.41401 6.87262 8.60202 6.18808 6.19569 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 9.14007 6.70767 5.26989 5.74529 6.94988 8.00633 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 5.80081 9.31967 4.25566 6.27844 9.78667 11.1956 numMergedOcc 0
16 mol 141 unq 2 iso 0 dist 5.80081 9.31967 4.25566 6.2491 8.47026 9.65952 numMergedOcc 0
17 mol 141 unq 3 iso 0 dist 5.80081 10.5556 6.63171 6.27844 9.78667 14.6024 numMergedOcc 0
18 mol 141 unq 4 iso 0 dist 5.80081 10.5556 6.63171 6.2491 8.47026 11.3036 numMergedOcc 0
19 mol 141 unq 5 iso 0 dist 5.80081 10.0306 7.67273 6.27844 9.78667 11.2383 numMergedOcc 0
20 mol 141 unq 6 iso 0 dist 5.80081 10.0306 7.67273 6.2491 8.47026 7.19116 numMergedOcc 0
21 mol 141 unq 7 iso 0 dist 9.45931 14.0561 7.31037 12.0446 6.73983 11.1956 numMergedOcc 0
22 mol 141 unq 8 iso 0 dist 9.45931 14.0561 7.31037 15.1652 8.6387 9.65952 numMergedOcc 0
23 mol 141 unq 9 iso 0 dist 6.49728 9.31967 7.31037 6.27844 6.73983 11.1956 numMergedOcc 0
24 mol 141 unq 10 iso 0 dist 6.49728 9.31967 7.31037 6.2491 8.6387 9.65952 numMergedOcc 0
25 mol 156 unq 0 iso 0 dist 6.97467 9.32932 6.05323 7.94812 7.46845 5.33988 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 8.89293 6.29996 8.97471 5.26093 7.02575 6.20673 numMergedOcc 0
27 mol 227 unq 0 iso 0 dist 8.85568 5.31715 9.28891 5.98086 7.95359 4.3387 numMergedOcc 0
28 mol 237 unq 0 iso 0 dist 6.78301 6.39326 5.98039 12.2119 6.07878 9.38038 numMergedOcc 0
29 mol 250 unq 0 iso 0 dist 9.5174 6.92778 6.28538 9.67078 5.93798 7.62569 numMergedOcc 0
30 mol 253 unq 0 iso 0 dist 7.06589 10.6548 9.58354 5.37783 8.15091 14.5407 numMergedOcc 0
31 mol 253 unq 1 iso 0 dist 8.70383 3.494 9.58354 14.5125 8.15091 14.5407 numMergedOcc 0
