0 mol 53 unq 0 iso 0 dist 6.78966 6.81867 5.21227 4.54851 10.5063 8.19958 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 9.94222 9.19528 4.68985 8.53337 12.9602 9.38538 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.93243 6.02731 10.029 4.85685 5.83263 8.21895 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 7.35476 5.19645 4.2144 7.8377 10.3859 9.69694 numMergedOcc 0
4 mol 107 unq 0 iso 0 dist 7.06322 8.92347 11.2991 4.34186 10.2668 7.89505 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 5.6738 5.7085 8.69658 10.3017 8.46167 7.40338 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 8.8413 8.29394 5.25923 5.04742 8.20345 9.42762 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 8.8413 8.29394 5.25923 11.4019 5.38148 7.30244 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 7.82124 5.98534 5.25923 5.02162 8.20345 9.42762 numMergedOcc 0
9 mol 123 unq 3 iso 0 dist 7.82124 5.98534 5.25923 8.90549 5.38148 7.30244 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 6.16995 5.53183 6.67922 5.76262 9.28718 9.59327 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 6.16995 5.53183 6.67922 4.09924 9.68833 8.51399 numMergedOcc 0
12 mol 196 unq 0 iso 0 dist 6.23804 4.83135 3.68546 4.20473 8.94198 6.14222 numMergedOcc 0
13 mol 196 unq 1 iso 0 dist 6.66019 4.83135 6.56216 4.20473 9.49159 6.14222 numMergedOcc 0
14 mol 196 unq 2 iso 0 dist 9.88671 4.83135 7.25762 4.20473 8.79306 6.14222 numMergedOcc 0
15 mol 232 unq 0 iso 0 dist 7.68603 8.70651 6.25229 8.26136 13.2065 9.78273 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 6.26195 7.41653 11.0519 3.57554 8.27566 9.36974 numMergedOcc 0
