0 mol 18 unq 0 iso 0 dist 6.60128 6.45965 10.8382 8.95573 9.45185 5.867 10.4274 11.7921 7.9504 8.93025 numMergedOcc 0
1 mol 94 unq 0 iso 0 dist 5.4622 7.81363 12.8989 5.80964 10.7906 4.4432 10.5952 15.6429 6.91081 5.20598 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 8.6786 6.15185 8.44185 9.9443 11.3473 8.44086 11.3589 17.2302 9.8067 9.35867 numMergedOcc 0
3 mol 141 unq 0 iso 0 dist 6.47392 8.47476 10.5086 9.55297 11.805 5.65619 13.6955 18.2934 9.28415 12.1389 numMergedOcc 0
4 mol 141 unq 1 iso 0 dist 6.47392 8.47476 10.5086 7.447 5.34489 14.1869 13.6955 18.2934 9.28415 20.153 numMergedOcc 0
5 mol 141 unq 2 iso 0 dist 6.47392 8.47476 10.5086 6.59782 4.93548 8.66026 13.6955 18.2934 9.28415 15.2606 numMergedOcc 0
6 mol 220 unq 0 iso 0 dist 7.30288 4.17978 6.85536 5.13604 6.32132 3.90017 6.21026 12.9449 8.65468 10.8855 numMergedOcc 0
7 mol 233 unq 0 iso 0 dist 6.09111 7.89581 4.73495 8.98366 6.99665 5.19341 6.13888 8.41604 6.87565 5.64376 numMergedOcc 0
8 mol 236 unq 0 iso 0 dist 6.35418 6.54859 7.34037 7.05868 4.99523 4.52208 7.55924 6.25412 9.26313 9.88216 numMergedOcc 0
9 mol 260 unq 0 iso 0 dist 7.5129 7.90537 11.113 9.50619 8.29529 5.51525 6.39739 5.16772 8.55211 7.26115 numMergedOcc 0
10 mol 260 unq 1 iso 0 dist 7.5129 7.90537 11.113 9.50619 8.29529 5.51525 4.9453 12.3287 8.44162 12.336 numMergedOcc 0
11 mol 287 unq 0 iso 0 dist 7.19754 6.38338 4.88674 8.70062 8.6202 4.26276 5.87542 5.96033 6.90956 8.40198 numMergedOcc 0
12 mol 287 unq 1 iso 0 dist 7.19754 6.38338 4.88674 9.919 5.64526 9.92609 5.87542 5.96033 6.90956 9.95761 numMergedOcc 0
13 mol 288 unq 0 iso 0 dist 7.19754 6.38338 4.88674 8.70062 8.6202 4.26276 5.87542 5.96033 6.90956 8.40198 numMergedOcc 0
14 mol 288 unq 1 iso 0 dist 7.19754 6.38338 4.88674 9.919 5.64526 9.92609 5.87542 5.96033 6.90956 9.95761 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 7.19754 6.38338 4.88674 8.70062 8.6202 4.26276 5.87542 5.96033 6.90956 8.40198 numMergedOcc 0
16 mol 289 unq 1 iso 0 dist 7.19754 6.38338 4.88674 9.919 5.64526 9.92609 5.87542 5.96033 6.90956 9.95761 numMergedOcc 0
