0 mol 34 unq 0 iso 0 dist 9.10681 6.10527 4.50643 9.67615 5.55479 3.92518 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 7.40218 4.48566 8.47518 5.02755 5.87258 4.6365 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.06519 4.69243 8.87951 5.45972 9.15275 4.73251 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 8.80303 9.66182 9.96522 12.9723 9.63348 5.19429 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 7.31138 4.37412 9.24998 9.65919 7.81965 9.94655 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 7.50959 4.66619 6.21554 11.1633 9.58844 6.5713 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 5.50402 9.75267 9.49584 10.6312 7.91109 11.3162 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 5.50402 9.75267 9.49584 9.58584 5.75808 12.0099 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 9.17333 11.7447 4.62366 11.2845 6.91511 4.65363 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 8.45309 4.62365 8.49577 15.6229 9.07247 13.4486 numMergedOcc 0
10 mol 193 unq 0 iso 0 dist 7.13192 3.79373 7.71716 4.0847 8.28942 7.03555 numMergedOcc 0
11 mol 212 unq 0 iso 0 dist 9.25573 4.25603 7.98724 8.99365 8.43638 7.52135 numMergedOcc 0
12 mol 222 unq 0 iso 0 dist 8.37114 8.84473 5.17916 5.03056 7.61739 6.4817 numMergedOcc 0
13 mol 222 unq 1 iso 0 dist 8.37114 8.84473 5.17916 3.91348 9.59191 8.05936 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.26044 5.22517 8.92121 9.42722 8.03092 11.1207 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 6.76938 4.59857 7.2154 9.59336 8.48003 6.87269 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 6.76938 4.59857 7.2154 5.70397 5.54003 4.4421 numMergedOcc 0
17 mol 243 unq 2 iso 0 dist 6.41279 8.81017 7.2154 8.94826 8.48003 6.87269 numMergedOcc 0
18 mol 243 unq 3 iso 0 dist 6.41279 8.81017 7.2154 5.7044 5.54003 4.4421 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 5.15432 9.70626 8.51994 9.50243 5.41277 7.98069 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 8.2375 4.37055 8.51994 10.2744 5.41277 7.98069 numMergedOcc 0
21 mol 279 unq 2 iso 0 dist 9.23951 5.46911 8.51994 9.14765 5.41277 7.98069 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 7.11605 7.87626 6.38295 9.85019 6.16546 4.06908 numMergedOcc 0
23 mol 283 unq 0 iso 0 dist 7.11407 4.88654 6.53354 9.46362 8.39635 7.87842 numMergedOcc 0
24 mol 283 unq 1 iso 0 dist 7.11407 11.4035 6.93798 9.46362 8.39635 5.55396 numMergedOcc 0
