0 mol 33 unq 0 iso 0 dist 9.69775 8.5865 17.0629 14.3321 22.7974 5.98867 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 9.01202 8.5865 15.3286 14.3321 21.1857 5.98867 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.77714 7.99735 5.41488 3.42062 9.77004 7.90416 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 7.77714 7.99735 5.41488 13.5492 8.36323 9.74553 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 6.46118 9.7516 5.41488 12.971 9.77004 7.90416 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 6.46118 9.7516 5.41488 4.70736 8.36323 9.74553 numMergedOcc 0
6 mol 71 unq 0 iso 0 dist 4.87767 7.92957 8.99245 6.01777 10.8002 9.69397 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 9.04246 6.09318 5.69836 6.42604 12.1585 7.50229 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 8.21723 6.00684 9.59932 6.02092 10.738 6.64921 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 9.59193 9.07154 13.3635 5.0146 13.1726 8.52131 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 8.12047 9.05572 11.0964 3.52268 7.77962 9.84239 numMergedOcc 0
11 mol 176 unq 1 iso 0 dist 8.12047 9.05572 11.0964 7.39809 8.6431 9.1728 numMergedOcc 0
12 mol 176 unq 2 iso 0 dist 8.12047 9.05572 11.0964 8.44347 11.4266 8.0255 numMergedOcc 0
13 mol 192 unq 0 iso 0 dist 7.74423 8.27545 5.21255 12.6116 13.0939 7.97601 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 5.1498 5.77947 5.31074 3.95521 8.95221 8.06847 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 8.31695 7.91999 7.79661 10.0567 15.3049 8.70416 numMergedOcc 0
16 mol 233 unq 1 iso 0 dist 8.31695 7.91999 7.79661 5.97893 12.7737 8.18379 numMergedOcc 0
17 mol 247 unq 0 iso 0 dist 9.69819 9.1776 6.27569 4.21655 9.42253 7.93894 numMergedOcc 0
18 mol 248 unq 0 iso 0 dist 6.80314 9.37614 4.13513 15.6281 13.6446 9.99025 numMergedOcc 0
19 mol 251 unq 0 iso 0 dist 5.63943 8.08045 5.16386 3.46172 6.63516 7.90148 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 5.81967 6.64109 5.51044 3.42654 5.14151 6.04835 numMergedOcc 0
21 mol 265 unq 1 iso 0 dist 9.19106 8.57593 5.51044 5.12694 5.14151 6.04835 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 8.51073 7.03817 5.40352 3.53168 9.76588 8.7752 numMergedOcc 0
23 mol 280 unq 1 iso 0 dist 6.30852 7.03817 4.54252 3.53168 8.9318 8.7752 numMergedOcc 0
