0 mol 61 unq 0 iso 0 dist 9.97224 3.30756 9.2934 9.12873 5.23555 7.93498 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 7.61405 5.86721 6.8173 10.4028 7.78899 4.8983 numMergedOcc 0
2 mol 111 unq 0 iso 0 dist 8.38367 7.42165 7.36025 13.8446 7.40992 8.11813 numMergedOcc 0
3 mol 120 unq 0 iso 0 dist 9.76171 10.3846 7.78914 12.5526 5.47516 7.50959 numMergedOcc 0
4 mol 120 unq 1 iso 0 dist 9.76171 10.3846 7.78914 15.0307 11.0725 5.24948 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 6.77889 5.906 6.94015 8.89564 4.1643 7.75833 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.18505 4.88335 9.88156 8.13344 5.16554 6.67937 numMergedOcc 0
7 mol 176 unq 0 iso 0 dist 6.02559 3.71345 7.69241 9.24242 5.22451 8.79752 numMergedOcc 0
8 mol 176 unq 1 iso 0 dist 6.02559 8.25138 7.77962 9.24242 5.22451 7.29985 numMergedOcc 0
9 mol 176 unq 2 iso 0 dist 6.02559 7.10617 8.6431 9.24242 5.22451 7.58281 numMergedOcc 0
10 mol 176 unq 3 iso 0 dist 8.12047 11.1744 7.69241 6.74185 5.22451 8.79752 numMergedOcc 0
11 mol 176 unq 4 iso 0 dist 8.12047 3.52268 7.77962 6.74185 5.22451 7.29985 numMergedOcc 0
12 mol 176 unq 5 iso 0 dist 8.12047 7.39809 8.6431 6.74185 5.22451 7.58281 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.26913 4.90099 6.92364 8.72113 4.96821 5.97886 numMergedOcc 0
14 mol 249 unq 0 iso 0 dist 8.9281 4.76162 9.38713 9.23283 13.364 6.62413 numMergedOcc 0
15 mol 251 unq 0 iso 0 dist 5.63943 3.46172 6.63516 7.73217 7.92068 8.15014 numMergedOcc 0
16 mol 251 unq 1 iso 0 dist 5.63943 3.46172 6.63516 9.34956 11.4966 6.06154 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.78656 4.12505 9.7875 9.04355 4.38561 9.31611 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 7.78656 4.12505 9.7875 8.50508 10.9625 6.25845 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.78656 4.12505 9.7875 9.04355 4.38561 9.31611 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 7.78656 4.12505 9.7875 8.50508 10.9625 6.25845 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.78656 4.12505 9.7875 9.04355 4.38561 9.31611 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 7.78656 4.12505 9.7875 8.50508 10.9625 6.25845 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 9.83077 13.986 7.89784 21.5955 12.618 9.25289 numMergedOcc 0
24 mol 292 unq 1 iso 0 dist 9.83077 13.986 7.89784 21.9113 16.1645 9.29687 numMergedOcc 0
25 mol 292 unq 2 iso 0 dist 8.45634 11.1761 7.89784 16.8152 12.618 9.25289 numMergedOcc 0
26 mol 292 unq 3 iso 0 dist 8.45634 11.1761 7.89784 20.3686 16.1645 9.29687 numMergedOcc 0
