0 mol 15 unq 0 iso 0 dist 5.70754 6.68607 9.62922 5.69927 8.4014 10.7239 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 7.89667 5.29322 8.10028 5.3315 8.31381 4.52042 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.36836 5.02379 9.48195 5.66535 9.99939 5.3372 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 7.36836 6.25207 7.07773 5.66535 9.99939 4.30086 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.4515 8.26216 5.7576 3.97569 6.23522 5.33851 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.4515 8.26216 5.7576 12.4903 9.10566 8.3449 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 8.4515 8.26216 5.7576 5.99117 9.62027 10.9046 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 6.3323 5.60821 7.68838 11.1132 7.44558 11.619 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 6.01857 5.76817 8.16392 11.1675 7.42146 11.8473 numMergedOcc 0
9 mol 122 unq 0 iso 0 dist 6.80798 9.01714 8.08737 4.42285 4.42563 7.21898 numMergedOcc 0
10 mol 168 unq 0 iso 0 dist 8.00063 5.97401 7.667 12.1014 8.92592 7.26802 numMergedOcc 0
11 mol 196 unq 0 iso 0 dist 6.10505 8.34289 9.5228 4.57882 4.67869 9.06413 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 7.49754 8.80849 8.64187 7.78293 8.82761 12.6417 numMergedOcc 0
13 mol 213 unq 1 iso 0 dist 7.49754 8.80849 8.64187 4.67262 4.66576 10.3241 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 8.54126 5.10642 4.76819 5.70808 8.60731 5.20266 numMergedOcc 0
15 mol 232 unq 1 iso 0 dist 7.64079 6.19573 4.76819 4.86949 8.60731 5.20266 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.60767 8.84737 5.57978 6.71528 6.76495 9.65708 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 9.60767 8.84737 5.57978 11.6193 5.4557 10.4505 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 8.25703 4.94787 8.90108 10.6892 8.12739 7.64772 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.84189 9.75427 7.29668 7.19628 5.30118 8.598 numMergedOcc 0
20 mol 287 unq 1 iso 0 dist 7.84189 9.75427 7.29668 11.7959 8.98698 10.9452 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 7.84189 9.75427 7.29668 7.19628 5.30118 8.598 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 7.84189 9.75427 7.29668 11.7959 8.98698 10.9452 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 7.84189 9.75427 7.29668 7.19628 5.30118 8.598 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 7.84189 9.75427 7.29668 11.7959 8.98698 10.9452 numMergedOcc 0
