0 mol 5 unq 0 iso 0 dist 6.40459 5.04052 4.59167 7.0627 6.94674 3.33561 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.58084 8.87863 4.59167 8.80355 5.34991 9.50135 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 9.8143 6.46284 15.7348 7.62938 14.7887 5.31713 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 8.73916 9.40953 8.5389 8.16102 9.73154 3.21417 numMergedOcc 0
4 mol 27 unq 1 iso 0 dist 8.73916 9.57896 10.0318 8.16102 9.73154 4.96577 numMergedOcc 0
5 mol 27 unq 2 iso 0 dist 5.66337 9.40953 10.0251 8.16102 10.602 3.21417 numMergedOcc 0
6 mol 27 unq 3 iso 0 dist 5.66337 9.57896 12.8706 8.16102 10.602 4.96577 numMergedOcc 0
7 mol 36 unq 0 iso 0 dist 6.9099 6.02824 7.55403 5.58536 8.72524 7.69482 numMergedOcc 0
8 mol 36 unq 1 iso 0 dist 7.23823 6.1084 7.55403 6.6055 6.28198 10.5994 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 7.6104 6.61587 6.70737 6.72584 4.48523 3.31218 numMergedOcc 0
10 mol 83 unq 1 iso 0 dist 7.6104 6.61587 6.70737 7.25594 9.79852 5.74818 numMergedOcc 0
11 mol 83 unq 2 iso 0 dist 7.6104 8.24464 11.1208 6.72584 4.48523 9.11262 numMergedOcc 0
12 mol 83 unq 3 iso 0 dist 7.6104 8.24464 11.1208 7.25594 9.79852 9.84043 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 6.29879 7.09831 4.85121 7.84085 4.63862 5.87276 numMergedOcc 0
14 mol 158 unq 0 iso 0 dist 7.75233 6.22696 4.12311 4.80508 3.86041 5.09517 numMergedOcc 0
15 mol 158 unq 1 iso 0 dist 7.75233 6.22696 4.12311 4.88625 5.05049 6.2149 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 9.6856 4.68544 10.5275 8.1953 3.60864 8.60565 numMergedOcc 0
17 mol 168 unq 1 iso 0 dist 9.6856 4.68544 10.5275 8.16253 7.08284 5.62227 numMergedOcc 0
18 mol 184 unq 0 iso 0 dist 7.73442 9.53656 6.63015 9.35481 10.3105 14.4056 numMergedOcc 0
19 mol 184 unq 1 iso 0 dist 7.73442 9.53656 6.63015 9.11936 15.3838 15.3702 numMergedOcc 0
20 mol 184 unq 2 iso 0 dist 7.73442 9.53656 6.63015 8.20517 13.085 9.99712 numMergedOcc 0
21 mol 184 unq 3 iso 0 dist 7.73442 7.06562 10.6362 9.35481 10.3105 5.54499 numMergedOcc 0
22 mol 184 unq 4 iso 0 dist 7.73442 7.06562 10.6362 9.11936 15.3838 6.15375 numMergedOcc 0
23 mol 184 unq 5 iso 0 dist 7.73442 7.06562 10.6362 8.20517 13.085 9.56022 numMergedOcc 0
24 mol 233 unq 0 iso 0 dist 6.58227 9.28828 4.5423 9.63067 6.98596 3.32222 numMergedOcc 0
25 mol 237 unq 0 iso 0 dist 6.73849 6.16312 5.86342 5.27463 3.64783 5.88058 numMergedOcc 0
26 mol 237 unq 1 iso 0 dist 9.43875 6.16312 5.08738 5.27463 10.1524 5.88058 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 8.66923 9.97859 4.70535 9.59909 15.9903 14.95 numMergedOcc 0
