0 mol 7 unq 0 iso 0 dist 8.05125 7.15434 9.17482 8.75346 8.88778 9.67164 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 5.41248 6.57999 10.1093 11.5556 16.8517 9.01112 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 7.45665 6.4754 4.62402 4.67793 10.5712 9.01112 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 7.45665 7.3795 5.66268 4.67793 10.5712 7.62333 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 6.59376 7.53042 7.12759 8.34136 10.7435 6.07517 numMergedOcc 0
5 mol 30 unq 1 iso 0 dist 8.18794 7.53042 4.43881 8.34136 7.6477 6.07517 numMergedOcc 0
6 mol 39 unq 0 iso 0 dist 8.86053 5.00126 8.20173 7.71511 15.4231 8.70192 numMergedOcc 0
7 mol 39 unq 1 iso 0 dist 8.76925 5.00126 8.11238 7.71511 14.5286 8.70192 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 7.62469 9.17086 5.39546 4.9903 8.21247 6.6263 numMergedOcc 0
9 mol 56 unq 0 iso 0 dist 4.80247 9.77018 10.6193 12.6833 13.2502 9.2898 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 6.7939 8.16299 7.80518 6.52486 10.4722 5.5087 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 6.7939 8.16299 7.80518 10.9731 12.7709 6.08682 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 6.85356 8.16299 11.6012 6.52486 12.6762 5.5087 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 6.85356 8.16299 11.6012 10.9731 16.0368 6.08682 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 8.44695 8.27015 7.80518 13.0059 10.4722 5.5087 numMergedOcc 0
15 mol 73 unq 5 iso 0 dist 8.44695 8.27015 7.80518 14.1533 12.7709 6.08682 numMergedOcc 0
16 mol 76 unq 0 iso 0 dist 9.225 8.41567 6.80777 6.65453 11.9664 6.72869 numMergedOcc 0
17 mol 76 unq 1 iso 0 dist 9.225 5.56964 9.95835 6.65453 11.9664 9.85905 numMergedOcc 0
18 mol 76 unq 2 iso 0 dist 5.37449 6.62246 4.80624 7.15288 9.73179 6.72869 numMergedOcc 0
19 mol 76 unq 3 iso 0 dist 9.52666 6.62246 6.80777 7.15288 11.9664 6.72869 numMergedOcc 0
20 mol 86 unq 0 iso 0 dist 9.67574 8.40609 7.89966 4.74546 12.6468 7.90423 numMergedOcc 0
21 mol 115 unq 0 iso 0 dist 9.47253 8.97043 10.1455 7.34308 13.9467 6.39384 numMergedOcc 0
22 mol 131 unq 0 iso 0 dist 9.14809 9.33945 14.651 9.88758 17.234 9.27976 numMergedOcc 0
23 mol 131 unq 1 iso 0 dist 6.45169 9.33945 7.47571 9.88758 13.3729 9.27976 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 9.11823 4.851 5.97687 6.13691 12.4467 6.67404 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 5.77828 8.96639 10.5857 9.54858 14.6615 8.82351 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 9.01742 9.38753 5.81768 11.5133 14.2124 9.07475 numMergedOcc 0
27 mol 238 unq 2 iso 0 dist 9.01742 9.38753 5.81768 12.2802 12.6941 6.99888 numMergedOcc 0
28 mol 238 unq 3 iso 0 dist 7.75366 7.64276 10.313 4.48114 5.52788 9.12776 numMergedOcc 0
29 mol 241 unq 0 iso 0 dist 8.00841 8.98668 12.7003 5.65355 13.3137 7.95042 numMergedOcc 0
