0 mol 12 unq 0 iso 0 dist 7.68446 6.05244 4.40652 9.23849 5.44478 7.4036 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 9.16791 4.95459 9.41369 6.39837 14.3039 5.58337 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 6.57452 4.95459 5.25902 6.39837 7.33546 5.58337 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 7.60412 4.76028 6.08127 5.26707 9.25371 9.51367 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 8.65807 7.35647 9.37324 15.106 10.1966 9.96946 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 5.19029 5.08086 5.65957 11.3977 14.5915 9.32254 numMergedOcc 0
6 mol 189 unq 0 iso 0 dist 9.36549 9.6509 6.37312 10.3814 9.07003 7.45329 numMergedOcc 0
7 mol 189 unq 1 iso 0 dist 6.77351 9.6509 6.41248 10.3814 8.81184 7.45329 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 6.6011 8.25221 8.7874 5.85988 11.247 7.27051 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 6.6011 6.64416 7.84006 5.85988 11.247 7.35424 numMergedOcc 0
10 mol 192 unq 2 iso 0 dist 8.82945 8.25221 14.0388 5.85988 14.6187 7.27051 numMergedOcc 0
11 mol 192 unq 3 iso 0 dist 8.82945 6.64416 11.6621 5.85988 14.6187 7.35424 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 5.99718 9.36738 6.23427 4.55979 7.42784 7.88169 numMergedOcc 0
13 mol 220 unq 1 iso 0 dist 5.99718 9.36738 6.23427 6.35303 6.11123 9.46179 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 8.25412 9.45021 6.10844 14.3715 9.09371 8.85568 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 6.85288 5.02385 6.69582 5.00251 5.00402 7.37358 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 4.98604 8.25538 12.5027 5.76658 10.6904 5.62568 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 4.98604 8.25538 12.5027 16.0716 20.218 8.82948 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 4.98604 8.25538 12.5027 5.76658 10.6904 5.62568 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 4.98604 8.25538 12.5027 16.0716 20.218 8.82948 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 4.98604 8.25538 12.5027 5.76658 10.6904 5.62568 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 4.98604 8.25538 12.5027 16.0716 20.218 8.82948 numMergedOcc 0
