0 mol 4 unq 0 iso 0 dist 6.85308 6.31358 8.67981 10.9005 6.12485 11.5212 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.85308 6.31358 8.67981 7.5562 9.04027 3.6405 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 9.37221 5.31844 6.73481 13.6066 7.50258 9.50033 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 7.45058 15.0803 9.1662 12.0646 6.49343 3.86843 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.20203 6.68148 5.37819 14.7779 8.15664 12.1737 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.10336 4.58095 5.01269 10.4694 9.23104 6.65104 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 8.96012 9.66759 5.9962 9.53698 8.76088 5.9683 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 8.96012 6.56331 8.61448 9.53698 8.76088 13.8877 numMergedOcc 0
8 mol 165 unq 0 iso 0 dist 9.87192 6.44666 8.68956 4.20818 8.7235 8.88567 numMergedOcc 0
9 mol 211 unq 0 iso 0 dist 8.19203 12.1528 9.26542 5.94027 5.6998 9.86881 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 9.62052 10.4869 7.47852 9.06809 7.65121 5.9027 numMergedOcc 0
11 mol 225 unq 1 iso 0 dist 9.62052 5.19872 6.22332 9.06809 7.65121 4.95393 numMergedOcc 0
12 mol 226 unq 0 iso 0 dist 7.59794 9.23534 7.54614 8.90041 8.74399 12.983 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 9.48237 13.6539 5.6568 16.9403 7.74348 4.24722 numMergedOcc 0
14 mol 250 unq 0 iso 0 dist 8.07416 5.34692 5.43868 9.23651 8.51703 9.96947 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 5.81378 10.6732 8.06908 10.496 8.54422 5.99165 numMergedOcc 0
16 mol 259 unq 1 iso 0 dist 5.81378 10.6732 8.06908 7.69574 7.67473 4.78344 numMergedOcc 0
17 mol 271 unq 0 iso 0 dist 9.14523 10.2378 7.29764 9.8595 9.00071 4.80845 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 8.84177 6.5189 5.76796 16.2395 7.872 11.2606 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 8.84177 6.5189 5.76796 10.7953 6.32984 8.7778 numMergedOcc 0
20 mol 293 unq 0 iso 0 dist 8.38758 6.16873 6.04186 5.06032 4.72125 6.74585 numMergedOcc 0
