0 mol 24 unq 0 iso 0 dist 9.67696 5.92191 7.33768 11.9066 9.69752 6.00575 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.12171 10.5449 9.41441 7.70921 6.2004 11.1124 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.12171 14.617 6.73939 7.70921 6.2004 10.2913 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.45854 4.17348 7.52354 5.06651 8.29345 7.23437 numMergedOcc 0
4 mol 108 unq 0 iso 0 dist 8.50992 10.051 9.01852 6.87606 6.12967 9.53349 numMergedOcc 0
5 mol 108 unq 1 iso 0 dist 8.00008 15.8859 9.01852 9.85061 6.12967 9.53349 numMergedOcc 0
6 mol 108 unq 2 iso 0 dist 7.79698 14.7085 9.01852 6.69989 6.12967 9.53349 numMergedOcc 0
7 mol 108 unq 3 iso 0 dist 7.18748 4.56297 9.01852 6.01373 6.12967 9.53349 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 8.65287 6.79537 9.99802 4.91324 6.95405 4.28797 numMergedOcc 0
9 mol 130 unq 1 iso 0 dist 5.65876 11.4341 9.72053 7.33795 8.91311 6.24241 numMergedOcc 0
10 mol 130 unq 2 iso 0 dist 5.65876 7.02907 7.7949 7.33795 8.91311 11.6508 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 8.9967 10.0484 9.90168 5.82527 5.56627 5.89022 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 8.9967 10.0484 9.90168 14.2635 8.50562 9.32969 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 6.41084 10.4817 8.10291 14.9542 9.78667 11.2667 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 6.41084 10.4817 8.10291 12.4212 8.47026 7.52924 numMergedOcc 0
15 mol 141 unq 2 iso 0 dist 6.8891 16.1376 9.97343 5.44816 7.64956 13.8236 numMergedOcc 0
16 mol 141 unq 3 iso 0 dist 6.8891 10.4675 9.70413 5.44816 7.64956 6.30121 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 5.87853 6.73556 9.72611 4.41466 7.11785 5.93488 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.71806 9.45062 8.65535 5.5201 6.37788 6.66155 numMergedOcc 0
19 mol 194 unq 1 iso 0 dist 7.71806 9.45062 8.65535 6.55595 8.7028 5.4499 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 9.639 12.1292 7.32294 7.32929 5.91727 5.74707 numMergedOcc 0
21 mol 226 unq 0 iso 0 dist 8.22952 6.25661 8.80683 12.3393 6.26945 10.142 numMergedOcc 0
22 mol 226 unq 1 iso 0 dist 8.22952 9.16105 6.11704 12.3393 6.26945 6.05184 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 9.61914 5.5592 9.01021 5.79235 5.0804 5.66732 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 8.91606 15.2651 8.00673 10.4329 7.21972 6.54009 numMergedOcc 0
25 mol 278 unq 1 iso 0 dist 8.91606 9.04802 6.62841 10.4329 7.21972 5.73336 numMergedOcc 0
