0 mol 4 unq 0 iso 0 dist 8.66947 9.31285 12.04 6.80703 9.71908 10.4062 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.90024 6.84521 5.06502 18.5048 9.74445 13.964 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.90024 6.78532 6.45462 18.5048 9.74445 15.3221 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 6.92837 8.27307 8.99811 5.74577 9.57969 13.9493 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 5.8992 9.29446 11.5966 5.18488 6.7763 13.7254 numMergedOcc 0
5 mol 89 unq 0 iso 0 dist 8.85873 7.3606 6.88931 11.2532 6.36021 12.5644 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.96446 6.70686 5.04493 14.2688 7.86724 10.6665 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 9.23803 8.05028 6.94915 5.20171 9.74643 6.86702 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 8.05028 9.23803 6.94915 5.20171 6.86702 9.74643 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 9.9633 8.64633 5.00116 9.40358 7.21229 8.39607 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 6.99793 6.71345 11.6284 5.67441 7.25166 8.42445 numMergedOcc 0
11 mol 114 unq 1 iso 0 dist 6.71345 6.99793 11.6284 5.67441 8.42445 7.25166 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 9.50575 8.64107 10.4152 9.78923 6.7225 11.6732 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 8.43116 6.23645 6.5838 7.46653 6.7225 10.2695 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 4.68975 8.84656 7.11631 8.95641 7.78849 14.0675 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 4.68975 4.9155 5.79898 8.95641 7.78849 11.4625 numMergedOcc 0
16 mol 196 unq 0 iso 0 dist 9.36732 9.79271 12.9389 7.21567 6.76923 14.8637 numMergedOcc 0
17 mol 206 unq 0 iso 0 dist 5.82039 6.22964 7.08143 10.3181 8.31638 14.4113 numMergedOcc 0
18 mol 206 unq 1 iso 0 dist 5.82039 6.22964 7.08143 8.09615 9.72979 6.97859 numMergedOcc 0
19 mol 206 unq 2 iso 0 dist 6.22964 5.82039 7.08143 5.85716 9.38127 10.0788 numMergedOcc 0
20 mol 206 unq 3 iso 0 dist 6.22964 5.82039 7.08143 8.09615 6.97859 9.72979 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 6.32302 6.88694 5.57838 5.47886 9.84492 10.7645 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 9.03917 6.56775 8.31875 10.7399 9.71281 10.7398 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.39537 8.97461 14.0328 6.39493 9.75174 14.7827 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 9.39537 8.89487 15.8898 6.39493 9.75174 12.6582 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 7.151 8.53324 7.69449 13.1772 9.98528 16.8282 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 7.151 7.23956 11.8268 13.1772 9.98528 19.4967 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 8.53324 7.151 7.69449 7.09461 9.02914 10.9325 numMergedOcc 0
28 mol 277 unq 3 iso 0 dist 8.53324 7.23956 7.08227 7.09461 9.02914 6.90434 numMergedOcc 0
29 mol 277 unq 4 iso 0 dist 7.23956 7.151 11.8268 7.09461 6.90434 10.9325 numMergedOcc 0
30 mol 277 unq 5 iso 0 dist 7.23956 8.53324 7.08227 7.09461 6.90434 9.02914 numMergedOcc 0
31 mol 277 unq 6 iso 0 dist 8.33977 8.66941 7.69449 17.7336 9.98528 16.8282 numMergedOcc 0
32 mol 277 unq 7 iso 0 dist 8.66941 8.33977 7.69449 16.013 9.02914 10.9325 numMergedOcc 0
33 mol 284 unq 0 iso 0 dist 9.98268 6.83147 5.87439 8.92414 8.27793 10.8451 numMergedOcc 0
34 mol 284 unq 1 iso 0 dist 9.98268 7.43241 17.2899 8.92414 8.27793 14.8535 numMergedOcc 0
