0 mol 11 unq 0 iso 0 dist 9.78518 8.14553 6.79478 14.5358 16.1353 9.53002 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 6.56878 10.1514 9.62468 10.8373 6.91052 8.76003 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 6.56395 10.1514 5.92705 10.8373 7.34319 8.76003 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 9.2309 4.59504 9.74996 8.71627 4.68683 7.04352 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 9.2309 4.59504 9.74996 10.9839 17.5002 8.1114 numMergedOcc 0
5 mol 87 unq 0 iso 0 dist 7.67411 7.2527 8.50159 13.4901 9.76372 7.51358 numMergedOcc 0
6 mol 87 unq 1 iso 0 dist 7.67411 7.2527 8.50159 14.0019 11.9014 8.93296 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 9.27657 11.0658 6.78459 14.4386 7.59628 4.76815 numMergedOcc 0
8 mol 140 unq 0 iso 0 dist 9.69499 7.49203 9.93572 9.7944 5.36419 7.27371 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 8.32453 5.01665 9.61081 7.13287 6.50232 7.31468 numMergedOcc 0
10 mol 143 unq 1 iso 0 dist 8.32453 4.9475 5.46922 7.13287 6.50232 7.7056 numMergedOcc 0
11 mol 143 unq 2 iso 0 dist 8.13798 14.1743 9.61081 13.8357 6.50232 7.31468 numMergedOcc 0
12 mol 143 unq 3 iso 0 dist 8.13798 9.53356 5.46922 13.8357 6.50232 7.7056 numMergedOcc 0
13 mol 143 unq 4 iso 0 dist 5.25485 13.1697 9.61081 10.2277 6.50232 7.31468 numMergedOcc 0
14 mol 143 unq 5 iso 0 dist 5.25485 9.28974 5.46922 10.2277 6.50232 7.7056 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 7.57267 5.6926 8.81169 10.9544 8.83831 8.47155 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 9.64653 16.0709 8.64255 13.6225 10.1284 8.99696 numMergedOcc 0
17 mol 197 unq 1 iso 0 dist 9.64653 16.0709 8.64255 19.4547 9.91133 7.85058 numMergedOcc 0
18 mol 197 unq 2 iso 0 dist 9.64653 16.0709 8.64255 15.9661 8.50763 9.96638 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 7.60093 7.39364 9.18675 6.06804 6.07589 5.86443 numMergedOcc 0
20 mol 227 unq 1 iso 0 dist 7.60093 7.39364 9.18675 11.4952 9.95811 7.22914 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 6.35728 5.28657 5.00515 7.54327 9.90298 6.16063 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 9.50104 7.64039 7.2346 14.3076 9.5053 7.32211 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 8.47921 11.0676 9.75174 6.89216 5.1967 6.91569 numMergedOcc 0
24 mol 249 unq 0 iso 0 dist 8.05967 7.31764 5.78121 11.9171 4.16447 8.96876 numMergedOcc 0
25 mol 249 unq 1 iso 0 dist 8.05967 12.5964 7.29898 11.9171 4.16447 8.83735 numMergedOcc 0
26 mol 249 unq 2 iso 0 dist 9.62613 12.5964 8.91685 11.9171 6.74838 8.83735 numMergedOcc 0
27 mol 249 unq 3 iso 0 dist 8.75137 10.7823 5.78121 10.7267 4.16447 8.96876 numMergedOcc 0
28 mol 249 unq 4 iso 0 dist 8.75137 4.24754 7.29898 10.7267 4.16447 8.83735 numMergedOcc 0
29 mol 249 unq 5 iso 0 dist 7.82699 4.24754 8.91685 10.7267 6.74838 8.83735 numMergedOcc 0
30 mol 257 unq 0 iso 0 dist 8.71571 5.85328 8.18901 12.4475 9.38826 7.27505 numMergedOcc 0
31 mol 277 unq 0 iso 0 dist 5.73065 11.9195 6.90434 10.6409 9.14131 9.41725 numMergedOcc 0
