0 mol 51 unq 0 iso 0 dist 5.67627 8.07329 10.9798 11.4974 9.0709 18.5147 numMergedOcc 0
1 mol 52 unq 0 iso 0 dist 6.08894 9.37288 9.64358 6.01116 7.34143 5.75761 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 9.45717 6.13502 15.0275 4.28997 6.82262 10.3346 numMergedOcc 0
3 mol 170 unq 0 iso 0 dist 7.47249 9.28803 5.36359 6.8201 9.76807 11.5324 numMergedOcc 0
4 mol 170 unq 1 iso 0 dist 7.47249 8.86902 8.84552 6.8201 9.76807 11.7022 numMergedOcc 0
5 mol 220 unq 0 iso 0 dist 5.07968 9.97464 7.40429 4.58603 9.41367 14.3759 numMergedOcc 0
6 mol 229 unq 0 iso 0 dist 9.68636 6.38661 5.31837 10.705 8.22528 10.662 numMergedOcc 0
7 mol 229 unq 1 iso 0 dist 9.68636 6.38661 5.31837 5.6419 7.03423 7.38552 numMergedOcc 0
8 mol 229 unq 2 iso 0 dist 7.81415 6.38661 4.74734 5.6419 9.06952 7.38552 numMergedOcc 0
9 mol 234 unq 0 iso 0 dist 9.5181 8.54475 12.6944 9.15708 9.36357 16.8802 numMergedOcc 0
10 mol 234 unq 1 iso 0 dist 9.5181 8.54475 12.6944 4.94699 6.7625 12.2193 numMergedOcc 0
11 mol 258 unq 0 iso 0 dist 9.80417 9.9553 4.88549 10.759 6.60405 8.14531 numMergedOcc 0
12 mol 259 unq 0 iso 0 dist 8.70852 7.48629 8.53114 5.07898 7.84554 7.64122 numMergedOcc 0
13 mol 259 unq 1 iso 0 dist 9.89728 7.48629 4.63899 5.07898 7.46176 7.64122 numMergedOcc 0
14 mol 259 unq 2 iso 0 dist 6.42437 7.48629 8.41812 5.07898 9.18903 7.64122 numMergedOcc 0
15 mol 264 unq 0 iso 0 dist 7.73693 7.68767 10.7283 5.00433 9.17653 12.625 numMergedOcc 0
