0 mol 7 unq 0 iso 0 dist 8.88982 11.2808 7.15434 11.2601 9.17482 8.05125 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 9.28346 8.66179 7.53042 11.7033 7.12759 6.59376 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 9.28346 8.66179 7.53042 9.41816 4.43881 8.18794 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.63534 10.8938 5.56964 11.9931 9.95835 9.225 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 8.51543 11.3845 8.41567 14.612 6.80777 9.225 numMergedOcc 0
5 mol 76 unq 2 iso 0 dist 8.51543 7.17313 6.62246 9.28357 4.80624 5.37449 numMergedOcc 0
6 mol 76 unq 3 iso 0 dist 8.51543 7.17313 6.62246 14.612 6.80777 9.52666 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 4.31067 5.88769 8.05602 11.0402 12.5137 5.26536 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 5.22628 6.64473 8.97043 11.8342 10.1455 9.47253 numMergedOcc 0
9 mol 125 unq 0 iso 0 dist 9.50809 6.43724 7.76202 11.5201 5.87414 8.75402 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 6.32178 5.58691 6.54987 6.25968 4.8408 6.00896 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 7.2977 5.35536 6.54987 9.31167 4.8408 6.00896 numMergedOcc 0
12 mol 140 unq 0 iso 0 dist 6.40792 6.09043 7.83582 9.16949 9.7827 6.55217 numMergedOcc 0
13 mol 140 unq 1 iso 0 dist 6.40792 6.09043 7.83582 8.65294 5.80354 7.21686 numMergedOcc 0
14 mol 140 unq 2 iso 0 dist 7.81701 10.7377 7.83582 11.4118 9.7827 6.55217 numMergedOcc 0
15 mol 140 unq 3 iso 0 dist 7.81701 10.7377 7.83582 10.2342 5.80354 7.21686 numMergedOcc 0
16 mol 174 unq 0 iso 0 dist 6.90813 10.67 6.04817 8.36618 4.69892 9.56869 numMergedOcc 0
17 mol 174 unq 1 iso 0 dist 6.90813 10.67 6.04817 11.6613 4.99043 7.37131 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 6.97756 7.64229 8.98668 13.4329 12.7003 8.00841 numMergedOcc 0
19 mol 252 unq 0 iso 0 dist 7.58175 13.462 6.41821 12.2727 4.90903 4.91772 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 5.31858 5.06393 8.21585 7.87577 5.90131 8.73425 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 5.31858 5.06393 8.21585 5.86702 4.51422 9.65711 numMergedOcc 0
