0 mol 1 unq 0 iso 0 dist 8.27735 9.11012 9.72202 9.80295 6.09918 5.0634 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.8576 5.83293 6.8464 13.0722 7.88043 11.4481 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 8.8576 5.83293 6.8464 16.4052 8.80762 13.9708 numMergedOcc 0
3 mol 14 unq 0 iso 0 dist 8.51112 10.7867 7.73217 5.58434 9.58855 7.68094 numMergedOcc 0
4 mol 14 unq 1 iso 0 dist 8.51112 6.38279 5.99703 5.58434 9.58855 6.45626 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 7.34549 8.23892 9.80897 14.0065 8.44506 16.1274 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 7.34549 5.19532 8.37225 14.0065 8.44506 13.0741 numMergedOcc 0
7 mol 26 unq 2 iso 0 dist 8.09068 14.6126 9.80897 8.26538 8.44506 16.1274 numMergedOcc 0
8 mol 26 unq 3 iso 0 dist 8.09068 9.51004 8.37225 8.26538 8.44506 13.0741 numMergedOcc 0
9 mol 26 unq 4 iso 0 dist 9.72289 17.2928 9.80897 10.9934 8.44506 16.1274 numMergedOcc 0
10 mol 26 unq 5 iso 0 dist 9.72289 12.8246 8.37225 10.9934 8.44506 13.0741 numMergedOcc 0
11 mol 33 unq 0 iso 0 dist 9.8294 4.58881 5.52992 13.7035 8.00177 9.54828 numMergedOcc 0
12 mol 38 unq 0 iso 0 dist 9.70612 13.6797 9.30722 11.0716 7.57959 5.85014 numMergedOcc 0
13 mol 38 unq 1 iso 0 dist 9.70612 13.6797 9.30722 5.59494 7.05737 9.79259 numMergedOcc 0
14 mol 76 unq 0 iso 0 dist 7.63534 12.1289 8.77218 7.28582 4.79949 5.05789 numMergedOcc 0
15 mol 76 unq 1 iso 0 dist 7.63534 12.1289 8.77218 8.88157 7.27693 8.44806 numMergedOcc 0
16 mol 129 unq 0 iso 0 dist 6.47346 11.0685 8.59695 5.75556 8.03372 7.36759 numMergedOcc 0
17 mol 129 unq 1 iso 0 dist 6.47346 3.86284 6.42706 5.75556 8.03372 7.79894 numMergedOcc 0
18 mol 178 unq 0 iso 0 dist 7.14849 12.4035 9.63185 6.72936 4.92088 6.80181 numMergedOcc 0
19 mol 178 unq 1 iso 0 dist 8.63718 7.28647 9.63185 9.74054 4.92088 6.80181 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 6.20646 12.7269 9.44947 8.75405 6.85441 4.80028 numMergedOcc 0
21 mol 204 unq 1 iso 0 dist 6.73266 7.03981 9.44947 7.32929 6.85441 4.80028 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 6.04106 11.4325 7.51951 10.0849 5.60393 6.95682 numMergedOcc 0
23 mol 206 unq 0 iso 0 dist 7.51923 4.45877 8.95375 7.21122 8.70977 11.157 numMergedOcc 0
24 mol 206 unq 1 iso 0 dist 7.51923 10.6096 9.29007 7.21122 8.70977 7.41593 numMergedOcc 0
25 mol 234 unq 0 iso 0 dist 6.15754 9.92466 5.46736 14.1265 8.24186 9.52353 numMergedOcc 0
26 mol 234 unq 1 iso 0 dist 6.6281 6.70367 5.46736 14.0259 8.24186 9.52353 numMergedOcc 0
27 mol 236 unq 0 iso 0 dist 5.99137 7.15062 7.87233 10.968 8.50331 15.7632 numMergedOcc 0
