0 mol 20 unq 0 iso 0 dist 4.90613 6.30355 6.83357 9.4232 12.605 7.55864 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 4.90613 6.02975 4.71011 9.4232 12.605 9.33568 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.32779 9.04898 4.39474 6.51016 9.67926 9.68362 numMergedOcc 0
3 mol 81 unq 0 iso 0 dist 7.91009 5.77889 6.17229 7.09667 13.1052 8.6092 numMergedOcc 0
4 mol 81 unq 1 iso 0 dist 7.91009 6.91587 8.36931 13.9016 10.9864 8.82476 numMergedOcc 0
5 mol 81 unq 2 iso 0 dist 7.91009 6.91587 8.36931 12.5083 15.4711 9.78923 numMergedOcc 0
6 mol 81 unq 3 iso 0 dist 7.91009 6.91587 8.36931 7.09667 13.1052 6.38981 numMergedOcc 0
7 mol 81 unq 4 iso 0 dist 4.39121 8.22976 6.17229 12.1659 13.1052 8.6092 numMergedOcc 0
8 mol 81 unq 5 iso 0 dist 4.39121 8.9512 8.36931 10.6966 10.9864 8.82476 numMergedOcc 0
9 mol 81 unq 6 iso 0 dist 4.39121 8.9512 8.36931 13.1407 15.4711 9.78923 numMergedOcc 0
10 mol 81 unq 7 iso 0 dist 4.39121 8.9512 8.36931 12.1659 13.1052 6.38981 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 9.61273 9.64066 5.47938 4.30029 9.76171 7.48283 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 7.24083 5.03702 8.83242 5.20574 9.98988 7.46623 numMergedOcc 0
13 mol 132 unq 0 iso 0 dist 8.78382 8.96089 4.01392 9.98904 7.79845 7.17412 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 9.1717 6.98057 12.5558 9.41416 16.8997 6.48738 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 9.67795 5.66536 13.745 11.0772 20.7379 9.03055 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 9.64578 8.00415 10.9092 11.0598 15.1528 5.55434 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 7.02833 8.00415 7.3483 11.0598 12.1205 5.55434 numMergedOcc 0
18 mol 247 unq 0 iso 0 dist 6.52457 6.16117 3.56045 6.67746 8.81684 6.50869 numMergedOcc 0
19 mol 247 unq 1 iso 0 dist 6.52457 6.16117 3.56045 9.74878 12.6506 9.54682 numMergedOcc 0
