0 mol 10 unq 0 iso 0 dist 6.05338 4.87654 6.02154 4.84364 6.50154 4.68389 8.16906 4.27432 9.89713 8.7908 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 9.38546 12.1753 7.08841 9.08341 5.34723 3.44035 11.8649 5.64409 11.2439 9.2087 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.72467 9.0284 5.91068 7.65753 9.56614 12.7313 10.5563 9.78639 11.9703 4.75881 numMergedOcc 0
3 mol 143 unq 0 iso 0 dist 8.22353 11.3315 8.18023 11.9534 8.08798 14.4074 9.99012 4.19541 11.7801 4.3855 numMergedOcc 0
4 mol 143 unq 1 iso 0 dist 8.22353 12.1494 7.46803 11.9534 8.08798 5.94217 9.99012 4.19541 6.60366 4.3855 numMergedOcc 0
5 mol 143 unq 2 iso 0 dist 8.57285 14.6282 8.18023 5.08025 8.08798 14.4074 5.33772 4.19541 11.7801 4.3855 numMergedOcc 0
6 mol 143 unq 3 iso 0 dist 8.57285 7.11802 7.46803 5.08025 8.08798 5.94217 5.33772 4.19541 6.60366 4.3855 numMergedOcc 0
7 mol 214 unq 0 iso 0 dist 6.96139 10.0389 9.58372 6.49466 7.72298 3.64285 10.3757 6.05252 7.70062 7.96338 numMergedOcc 0
8 mol 214 unq 1 iso 0 dist 6.96139 10.0389 9.58372 6.49466 7.72298 3.64285 9.53899 4.00138 7.66702 7.42759 numMergedOcc 0
9 mol 254 unq 0 iso 0 dist 8.5372 8.2786 9.66641 11.4342 7.23916 8.8967 9.84028 6.19835 5.6417 7.85841 numMergedOcc 0
10 mol 254 unq 1 iso 0 dist 8.5372 8.2786 9.66641 11.2466 6.12653 10.929 9.84028 6.19835 5.6417 9.20109 numMergedOcc 0
11 mol 254 unq 2 iso 0 dist 8.5372 5.20737 9.26575 11.4342 7.23916 9.42679 9.84028 6.19835 7.42831 7.85841 numMergedOcc 0
12 mol 254 unq 3 iso 0 dist 8.5372 5.20737 9.26575 11.2466 6.12653 10.706 9.84028 6.19835 7.42831 9.20109 numMergedOcc 0
13 mol 260 unq 0 iso 0 dist 7.58405 4.35925 8.5613 8.79837 5.30187 10.6938 13.0633 5.91135 14.3252 6.48099 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 8.40198 13.2367 8.59762 12.0298 5.50067 3.66473 14.6295 8.99193 4.93516 4.68668 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 9.11967 12.7902 8.59762 11.6897 5.50067 3.66473 16.0429 8.99193 4.93516 4.68668 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 8.40198 13.2367 8.59762 12.0298 5.50067 3.66473 14.6295 8.99193 4.93516 4.68668 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 9.11967 12.7902 8.59762 11.6897 5.50067 3.66473 16.0429 8.99193 4.93516 4.68668 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 8.40198 13.2367 8.59762 12.0298 5.50067 3.66473 14.6295 8.99193 4.93516 4.68668 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 9.11967 12.7902 8.59762 11.6897 5.50067 3.66473 16.0429 8.99193 4.93516 4.68668 numMergedOcc 0
