0 mol 24 unq 0 iso 0 dist 8.15652 8.23069 4.93188 15.461 9.65174 13.5399 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.15652 8.59466 9.24958 15.461 9.65174 15.0923 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.44893 9.67461 4.93188 4.30555 9.65174 13.5399 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.44893 14.0586 9.24958 4.30555 9.65174 15.0923 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.2612 5.2549 8.44506 5.01774 9.41425 6.33493 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 6.40398 10.9094 8.7817 7.69013 7.78893 12.6119 numMergedOcc 0
6 mol 30 unq 1 iso 0 dist 6.40398 10.9094 8.7817 11.7275 5.85146 11.8413 numMergedOcc 0
7 mol 30 unq 2 iso 0 dist 6.40398 11.8694 7.55415 7.69013 7.78893 10.5615 numMergedOcc 0
8 mol 30 unq 3 iso 0 dist 6.40398 11.8694 7.55415 11.7275 5.85146 7.87211 numMergedOcc 0
9 mol 70 unq 0 iso 0 dist 9.33262 9.9009 9.31969 13.3525 7.34145 12.0751 numMergedOcc 0
10 mol 70 unq 1 iso 0 dist 9.33262 9.66495 6.54023 13.3525 7.34145 6.93285 numMergedOcc 0
11 mol 70 unq 2 iso 0 dist 4.67358 9.17087 9.31969 5.00416 7.34145 12.0751 numMergedOcc 0
12 mol 70 unq 3 iso 0 dist 4.67358 5.33532 6.54023 5.00416 7.34145 6.93285 numMergedOcc 0
13 mol 109 unq 0 iso 0 dist 9.9387 10.4339 8.67766 14.2274 9.67274 10.8085 numMergedOcc 0
14 mol 109 unq 1 iso 0 dist 9.9387 4.91393 8.0831 14.2274 9.67274 10.1337 numMergedOcc 0
15 mol 114 unq 0 iso 0 dist 5.36473 9.04668 9.7918 8.14095 6.4569 4.97363 numMergedOcc 0
16 mol 198 unq 0 iso 0 dist 5.33789 9.81415 9.18635 5.73959 5.20846 9.65062 numMergedOcc 0
17 mol 198 unq 1 iso 0 dist 5.33789 5.21925 8.10985 5.73959 5.20846 4.27652 numMergedOcc 0
18 mol 198 unq 2 iso 0 dist 7.27215 6.05803 9.18635 9.80167 5.20846 9.65062 numMergedOcc 0
19 mol 198 unq 3 iso 0 dist 7.27215 10.854 8.10985 9.80167 5.20846 4.27652 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 9.88251 14.4147 8.44861 11.0081 5.19567 9.96193 numMergedOcc 0
21 mol 205 unq 1 iso 0 dist 9.88251 13.9684 5.60393 11.0081 5.19567 4.30308 numMergedOcc 0
22 mol 209 unq 0 iso 0 dist 6.43914 5.35615 8.41195 4.41097 9.90699 5.36295 numMergedOcc 0
23 mol 230 unq 0 iso 0 dist 6.47064 10.7614 9.09271 7.72583 7.83105 12.9537 numMergedOcc 0
24 mol 230 unq 1 iso 0 dist 6.47064 10.7614 9.09271 11.7343 5.63025 12.3005 numMergedOcc 0
25 mol 230 unq 2 iso 0 dist 6.47064 11.777 7.44838 7.72583 7.83105 10.9745 numMergedOcc 0
26 mol 230 unq 3 iso 0 dist 6.47064 11.777 7.44838 11.7343 5.63025 8.05169 numMergedOcc 0
27 mol 252 unq 0 iso 0 dist 8.62351 6.79111 8.47784 14.4633 9.76731 17.5547 numMergedOcc 0
28 mol 252 unq 1 iso 0 dist 8.62351 6.79111 8.47784 12.2716 8.38599 14.3189 numMergedOcc 0
29 mol 252 unq 2 iso 0 dist 8.62351 14.2609 8.66469 14.4633 9.76731 11.5735 numMergedOcc 0
30 mol 252 unq 3 iso 0 dist 8.62351 14.2609 8.66469 12.2716 8.38599 6.19934 numMergedOcc 0
31 mol 252 unq 4 iso 0 dist 9.45457 9.00146 6.86945 5.45887 8.38453 9.93981 numMergedOcc 0
32 mol 252 unq 5 iso 0 dist 6.94319 11.8815 8.47784 12.6745 9.76731 17.5547 numMergedOcc 0
33 mol 252 unq 6 iso 0 dist 6.94319 11.8815 8.47784 9.62252 8.38599 14.3189 numMergedOcc 0
34 mol 252 unq 7 iso 0 dist 6.94319 5.29359 8.66469 12.6745 9.76731 11.5735 numMergedOcc 0
35 mol 252 unq 8 iso 0 dist 6.94319 5.29359 8.66469 9.62252 8.38599 6.19934 numMergedOcc 0
