0 mol 24 unq 0 iso 0 dist 9.7649 14.2346 7.18124 10.5243 8.25818 7.19357 15.3398 10.0962 7.84552 5.65754 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.5268 11.9263 7.18124 10.2093 8.25818 7.19357 14.3641 10.0962 7.84552 5.65754 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.10496 9.85109 8.56807 6.55665 6.87277 3.30907 10.9533 5.2103 7.75449 7.88072 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 8.06894 10.9018 7.73753 11.2724 8.14512 5.98039 11.9172 5.04771 9.25631 6.89855 numMergedOcc 0
4 mol 63 unq 1 iso 0 dist 8.06894 10.9018 7.73753 11.2724 8.14512 5.98039 16.1877 9.28052 7.87739 7.85738 numMergedOcc 0
5 mol 63 unq 2 iso 0 dist 5.89846 7.97838 7.73753 6.63195 8.14512 5.98039 8.17492 5.04771 9.25631 6.89855 numMergedOcc 0
6 mol 63 unq 3 iso 0 dist 5.89846 7.97838 7.73753 6.63195 8.14512 5.98039 12.3166 9.28052 7.87739 7.85738 numMergedOcc 0
7 mol 63 unq 4 iso 0 dist 8.69452 10.0014 8.90965 7.57912 7.23828 6.2569 18.0888 15.4558 9.16773 15.261 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 8.39335 3.84261 9.86479 11.779 9.07629 14.7216 9.43893 9.69493 7.85668 17.9998 numMergedOcc 0
9 mol 78 unq 1 iso 0 dist 8.39335 3.84261 9.86479 13.0405 8.61143 16.1736 9.43893 9.69493 7.85668 16.285 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 8.92653 11.2682 6.9447 8.70619 5.20429 3.80877 13.1731 9.6722 8.70907 10.8178 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 8.92653 11.2682 6.9447 8.70619 5.20429 3.80877 17.6443 9.93441 9.91644 12.0573 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 8.92653 11.2682 6.9447 3.89959 8.71366 12.771 13.1731 9.6722 8.70907 15.4206 numMergedOcc 0
13 mol 93 unq 3 iso 0 dist 8.92653 11.2682 6.9447 3.89959 8.71366 12.771 17.6443 9.93441 9.91644 18.4102 numMergedOcc 0
14 mol 111 unq 0 iso 0 dist 5.53271 6.02783 7.24101 7.42165 9.34782 12.2767 12.763 9.11894 9.01984 16.765 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 7.43884 5.7413 7.24165 11.4637 7.80711 13.7573 13.6849 9.52953 9.27812 14.5631 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 7.43884 5.7413 7.24165 12.3524 9.9965 10.0357 13.6849 9.52953 9.27812 6.48382 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 9.82274 14.2357 9.90494 4.3196 7.31132 12.6476 19.5432 14.4844 6.69313 18.6194 numMergedOcc 0
18 mol 283 unq 1 iso 0 dist 9.82274 7.50757 5.90121 4.3196 7.31132 3.31521 11.196 5.01922 9.83528 10.3573 numMergedOcc 0
19 mol 283 unq 2 iso 0 dist 7.17276 8.40497 9.90494 6.30031 7.31132 12.6476 13.4123 14.4844 6.69313 18.6194 numMergedOcc 0
20 mol 283 unq 3 iso 0 dist 7.17276 8.03948 5.90121 6.30031 7.31132 3.31521 9.16563 5.01922 9.83528 10.3573 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 9.14217 7.76761 9.97939 9.84883 4.68668 7.67746 13.4979 9.08224 8.71214 8.17436 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.14217 7.76761 9.97939 9.84883 4.68668 7.67746 13.4979 9.08224 8.71214 8.17436 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.14217 7.76761 9.97939 9.84883 4.68668 7.67746 13.4979 9.08224 8.71214 8.17436 numMergedOcc 0
