0 mol 11 unq 0 iso 0 dist 6.40513 4.54105 5.96346 9.33059 4.10106 6.859 5.9863 4.61088 6.86684 6.54358 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.85331 15.2995 9.01567 15.6713 8.91183 6.19899 17.3093 11.0194 4.50066 5.68215 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.85331 12.8157 7.29868 15.6713 8.91183 6.61696 17.3093 11.0194 5.11617 5.68215 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.85331 12.8157 7.29868 8.14598 5.69214 5.80953 9.20254 6.86014 8.52463 7.95042 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 8.23292 14.4951 7.45383 14.1443 6.47509 5.20109 12.4427 5.04899 7.33728 7.05196 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 6.85677 5.00632 6.73586 10.7143 4.39676 8.67537 4.99061 6.18601 5.13589 8.95212 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 6.85677 5.00632 6.73586 10.7143 4.39676 8.67537 14.536 10.1813 10.8661 6.99446 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 6.85677 5.00632 6.73586 10.7143 4.39676 8.67537 14.2612 9.72413 12.0175 7.64052 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 7.5984 11.4055 7.78652 9.33882 4.78563 5.06564 5.11989 5.99315 6.48978 5.37047 numMergedOcc 0
9 mol 143 unq 1 iso 0 dist 7.5984 9.54731 8.91301 9.33882 4.78563 7.5373 5.11989 5.99315 5.20762 5.37047 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 8.66709 12.1461 6.53347 5.55218 7.10286 9.24038 13.8829 10.7829 6.89781 8.97626 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.63295 14.1039 5.9176 17.7213 10.6474 8.12266 12.5935 7.63312 5.63555 6.64173 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 9.63295 14.1039 5.9176 11.1521 5.12833 9.43306 12.5935 7.63312 5.63555 9.55105 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 9.63295 5.39949 6.41453 8.39573 5.93724 5.99437 12.5935 7.63312 7.20191 9.01624 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 9.63295 5.39949 6.41453 8.39573 5.93724 5.99437 4.681 9.11469 5.48529 5.05973 numMergedOcc 0
15 mol 181 unq 4 iso 0 dist 9.63295 5.39949 6.41453 11.1521 5.12833 8.4848 12.5935 7.63312 7.20191 9.55105 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 7.95028 6.58929 7.14503 14.5916 9.71636 8.66624 14.6698 13.353 8.77113 7.88013 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 8.69148 8.56453 7.67576 13.422 6.84862 8.43195 9.97859 7.21333 7.75656 5.56538 numMergedOcc 0
18 mol 222 unq 1 iso 0 dist 8.69148 8.56453 7.67576 15.096 9.53117 8.23406 9.97859 7.21333 7.75656 7.48954 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 6.54753 7.10817 8.83865 10.7274 8.56043 6.35532 10.2261 13.3579 4.60101 9.59325 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 9.81087 13.6675 7.46394 9.71389 5.22914 7.77765 18.685 12.3938 9.5468 9.30212 numMergedOcc 0
21 mol 274 unq 1 iso 0 dist 9.81087 13.6675 7.46394 22.2821 14.7507 9.65868 18.685 12.3938 9.5468 6.4611 numMergedOcc 0
22 mol 274 unq 2 iso 0 dist 9.79674 7.28382 8.91672 11.8611 16.5034 7.77765 16.4665 16.3286 9.5468 9.30212 numMergedOcc 0
23 mol 274 unq 3 iso 0 dist 9.79674 7.28382 8.91672 16.4504 12.5615 9.65868 16.4665 16.3286 9.5468 6.4611 numMergedOcc 0
