0 mol 12 unq 0 iso 0 dist 4.62913 7.8865 6.98179 4.60834 6.6051 9.75368 7.44542 10.1259 6.9065 8.15864 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 7.44542 7.8865 6.9065 4.60834 8.15864 9.75368 4.62913 10.1259 6.98179 6.6051 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 9.1662 8.94945 7.01367 3.86843 6.49343 5.41831 11.6253 12.2413 6.60684 9.78739 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 8.34804 9.46247 11 10.7182 8.27009 17.692 14.4837 10.6111 19.4535 6.04303 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 8.34804 9.46247 11 10.7182 8.27009 17.692 9.59265 6.9953 14.0903 6.12267 numMergedOcc 0
5 mol 139 unq 0 iso 0 dist 5.77343 6.34417 4.78289 4.19005 8.78382 8.96275 10.5546 9.781 8.16051 9.70154 numMergedOcc 0
6 mol 236 unq 0 iso 0 dist 8.20542 5.66569 10.2557 4.60599 8.63249 5.90804 9.73914 15.386 6.49831 7.74348 numMergedOcc 0
7 mol 236 unq 1 iso 0 dist 5.6568 6.11137 6.49831 4.24722 7.74348 5.90804 12.2537 15.386 10.2557 8.63249 numMergedOcc 0
8 mol 236 unq 2 iso 0 dist 5.6568 7.89744 6.81625 4.24722 7.74348 10.7277 12.2537 15.386 16.3226 8.63249 numMergedOcc 0
9 mol 250 unq 0 iso 0 dist 5.43868 9.16048 6.52586 9.96947 8.51703 10.8131 9.80833 6.53265 6.44136 5.07895 numMergedOcc 0
10 mol 250 unq 1 iso 0 dist 9.80833 9.16048 6.44136 9.96947 5.07895 10.8131 5.43868 6.53265 6.52586 8.51703 numMergedOcc 0
11 mol 258 unq 0 iso 0 dist 9.52903 5.73834 9.78068 9.6053 7.25618 10.0455 12.3615 7.64421 8.73372 8.70193 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 7.51446 8.12852 9.80419 9.47559 9.39714 16.6569 14.0391 13.1611 20.2702 6.57444 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 6.70414 9.29635 5.77904 12.5633 8.15119 4.81916 16.5458 11.3688 7.44724 6.66936 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 7.47179 7.26542 5.10722 6.53276 6.45597 9.32175 10.6184 5.69849 5.25077 9.18785 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 7.47179 7.26542 5.10722 6.53276 6.45597 9.32175 10.6184 5.69849 5.25077 9.18785 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 7.47179 7.26542 5.10722 6.53276 6.45597 9.32175 10.6184 5.69849 5.25077 9.18785 numMergedOcc 0
17 mol 293 unq 0 iso 0 dist 6.04186 9.55282 6.91752 6.74585 4.72125 11.5814 13.0622 8.71249 14.3615 7.41524 numMergedOcc 0
18 mol 293 unq 1 iso 0 dist 6.04186 9.55282 6.91752 6.74585 4.72125 11.5814 11.8289 6.3489 11.4018 6.42608 numMergedOcc 0
19 mol 293 unq 2 iso 0 dist 6.04186 6.27435 5.66805 6.74585 4.72125 5.44043 13.0622 8.71249 8.15525 7.41524 numMergedOcc 0
20 mol 293 unq 3 iso 0 dist 6.04186 6.27435 5.66805 6.74585 4.72125 5.44043 11.8289 6.3489 9.35524 6.42608 numMergedOcc 0
