0 mol 5 unq 0 iso 0 dist 8.70824 4.9568 10.7591 4.42081 8.97274 7.56229 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.93404 4.9568 3.91535 4.42081 7.5815 7.56229 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 5.55798 7.06029 4.13187 4.95654 7.82966 8.75375 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 5.55798 7.06029 4.13187 10.0025 8.26763 9.04293 numMergedOcc 0
4 mol 79 unq 2 iso 0 dist 5.55798 7.06029 4.13187 6.35003 6.30814 4.78333 numMergedOcc 0
5 mol 79 unq 3 iso 0 dist 5.55798 7.06029 4.13187 3.45432 7.318 9.18411 numMergedOcc 0
6 mol 83 unq 0 iso 0 dist 6.77845 9.94528 4.48523 11.6894 7.93119 11.0219 numMergedOcc 0
7 mol 83 unq 1 iso 0 dist 6.77845 9.94528 4.48523 6.51558 5.25361 5.35861 numMergedOcc 0
8 mol 83 unq 2 iso 0 dist 5.48555 8.94777 4.48523 10.6214 7.93119 11.0219 numMergedOcc 0
9 mol 83 unq 3 iso 0 dist 5.48555 8.94777 4.48523 9.07479 5.25361 5.35861 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 5.81553 9.60648 7.8359 3.82552 6.6536 9.66492 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.65267 8.22722 3.60683 3.84992 8.88752 11.0561 numMergedOcc 0
12 mol 168 unq 0 iso 0 dist 5.60956 6.48066 3.60864 9.43003 8.18217 7.0961 numMergedOcc 0
13 mol 168 unq 1 iso 0 dist 5.60956 6.48066 3.60864 8.01699 5.51167 8.21227 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 6.09291 7.50458 10.1931 6.22697 7.06772 7.65903 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 6.09291 5.79554 10.5136 6.22697 7.06772 5.97653 numMergedOcc 0
16 mol 169 unq 2 iso 0 dist 6.09291 4.22003 10.212 6.22697 7.06772 7.75523 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 5.21088 5.05414 3.9335 3.81315 7.75405 8.7652 numMergedOcc 0
18 mol 192 unq 1 iso 0 dist 5.21088 7.16964 5.31881 3.81315 7.75405 10.0838 numMergedOcc 0
19 mol 192 unq 2 iso 0 dist 8.25609 5.05414 10.6087 3.81315 7.49971 8.7652 numMergedOcc 0
20 mol 192 unq 3 iso 0 dist 8.25609 5.05414 10.6087 9.53633 9.07427 13.4673 numMergedOcc 0
21 mol 192 unq 4 iso 0 dist 8.25609 7.16964 13.6786 3.81315 7.49971 10.0838 numMergedOcc 0
22 mol 192 unq 5 iso 0 dist 8.25609 7.16964 13.6786 9.53633 9.07427 16.6697 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 8.47833 8.93485 6.82382 6.10058 7.53734 7.68686 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 5.05912 8.93485 9.27501 6.10058 9.79826 7.68686 numMergedOcc 0
25 mol 205 unq 2 iso 0 dist 5.47586 5.66636 6.82382 3.50446 7.53734 7.68686 numMergedOcc 0
26 mol 205 unq 3 iso 0 dist 6.60429 5.66636 9.27501 3.50446 9.79826 7.68686 numMergedOcc 0
27 mol 222 unq 0 iso 0 dist 4.87053 4.90656 5.63584 4.91709 7.99441 8.88902 numMergedOcc 0
28 mol 222 unq 1 iso 0 dist 4.87053 4.90656 5.63584 5.96186 6.71817 9.83916 numMergedOcc 0
29 mol 222 unq 2 iso 0 dist 4.87053 4.90656 5.63584 9.55743 8.41524 13.2186 numMergedOcc 0
30 mol 233 unq 0 iso 0 dist 9.44671 9.69772 7.82473 13.5179 8.93995 16.0169 numMergedOcc 0
31 mol 283 unq 0 iso 0 dist 5.90728 9.35302 12.6455 5.14231 5.32876 13.6064 numMergedOcc 0
32 mol 283 unq 1 iso 0 dist 5.90728 9.35302 12.6455 4.25884 7.60296 13.0176 numMergedOcc 0
33 mol 283 unq 2 iso 0 dist 5.90728 8.85163 7.97597 5.14231 5.32876 11.5443 numMergedOcc 0
34 mol 283 unq 3 iso 0 dist 5.90728 8.85163 7.97597 4.25884 7.60296 11.6249 numMergedOcc 0
35 mol 287 unq 0 iso 0 dist 6.96248 6.16127 8.95194 11.9352 8.43856 15.192 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 6.96248 6.16127 8.95194 11.9352 8.43856 15.192 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 6.96248 6.16127 8.95194 11.9352 8.43856 15.192 numMergedOcc 0
