114
energy: -535.038058
C	0.238268	0.836291	-1.314997
C	1.089637	0.859066	1.660479
C	0.620903	0.053821	-0.365309
C	-0.148119	0.326361	-2.443898
C	-0.591544	1.648001	0.620342
C	-1.323391	1.502855	1.690197
C	-1.609952	0.027795	-0.301397
C	1.773998	-2.252238	0.899962
C	0.472739	-2.246495	0.803530
C	-0.882789	1.469943	-1.194006
C	1.277566	-0.943821	-0.850072
C	2.402403	-1.254423	1.469009
C	-0.217917	-2.133546	-2.032530
C	2.385870	0.860117	1.752396
C	-0.255816	-2.396272	1.869611
C	-0.877386	0.177005	-1.372014
C	-1.273679	0.962049	-2.325644
C	-2.347266	1.175683	0.941999
C	0.544683	-1.092943	0.220376
C	-1.953835	-0.907288	1.725632
C	1.169441	2.111294	0.301291
C	-1.613966	1.321016	-0.125419
C	1.202376	-2.097882	-0.262806
C	-0.494855	0.686301	-0.242954
C	-1.263520	-0.335276	-2.499497
C	0.979786	-0.309764	-2.561741
C	0.439801	-0.245912	1.860649
C	-0.642912	-2.920650	0.739073
C	-1.296639	-1.914978	1.232172
C	1.261147	1.153870	-0.568949
C	-1.713957	2.292616	0.732816
C	2.462316	-0.098092	0.875590
C	-1.593715	-1.266036	-0.472114
C	-0.112883	-0.095638	0.707091
C	-2.734712	0.664464	-0.190400
C	0.871797	1.949973	-1.517984
C	1.355885	0.203441	-1.438816
C	-0.984481	2.439438	-0.333647
C	-2.326966	-1.418154	0.594402
C	-0.204013	0.855445	1.572325
C	0.042418	2.759669	0.413634
C	-0.935414	0.709303	2.645190
C	-1.992128	-0.483083	-1.430434
C	-0.918945	-1.394983	2.363199
C	0.248389	-0.456794	-1.488287
C	-0.847266	-0.245300	1.781004
C	1.656279	0.716957	2.818725
C	-1.218506	-0.755572	0.655523
C	-0.564854	-1.762068	0.163352
C	-0.862536	-1.117109	-1.540703
C	0.969624	0.988345	-2.387779
C	-2.002267	0.811958	-1.256883
C	1.106130	-1.249093	1.377957
C	1.672909	-1.408255	2.533923
C	-0.133625	-0.971412	-2.611082
C	0.439811	1.962682	1.367617
C	-0.288716	-0.395519	2.934538
C	-0.484743	-0.605638	-0.416090
C	0.898555	-1.467859	-1.976019
C	1.011069	1.817402	2.530897
C	0.085696	-2.770214	-0.327443
C	-1.228626	0.537512	0.828812
C	-0.153934	1.622424	-2.263470
C	-1.676982	-2.430730	0.099837
C	1.172410	-0.096537	0.788764
C	-2.344925	-0.121088	0.766649
C	1.730452	-0.247159	1.945180
C	0.377390	-1.400940	2.448956
C	1.906149	0.052756	-0.282361
C	-0.187598	-1.242248	1.291210
C	-1.963997	0.390822	1.899595
C	0.140186	1.797040	-0.449053
C	1.821134	1.008058	0.591424
C	-0.288771	1.815287	2.434005
C	-2.724552	-0.632861	-0.364255
C	-0.686217	2.612789	1.480616
C	0.528270	1.004610	0.501478
C	1.741037	1.962791	1.464849
C	1.006279	-0.395993	3.013602
C	0.166878	-1.613028	-0.906046
C	1.044097	-2.403868	1.965190
C	1.837629	-1.100100	0.308898
C	-0.947534	-2.280360	-0.966157
C	0.360850	0.712381	2.732165
C	0.816113	-2.623474	-1.393236
C	2.012298	-0.797944	-1.920700
C	1.932328	-1.950589	-1.328277
C	2.572304	-0.953878	-0.758825
C	1.995820	1.306340	-1.638694
C	2.643275	0.201673	-1.350454
C	2.555760	1.159443	-0.475612
C	2.502904	-2.106737	-0.166801
C	3.131453	-1.111177	0.402318
C	3.195924	0.049996	-0.186479
C	3.114818	1.014034	0.687127
C	2.469873	2.114532	0.398912
C	1.899360	2.260968	-0.763864
C	-0.254896	2.589799	-1.399544
C	0.772798	2.909963	-0.651678
C	-1.977114	-1.777075	-1.600501
C	-2.706168	-1.928256	-0.536375
C	-1.248965	-1.631450	-2.666022
C	-2.392061	0.301205	-2.387304
C	-3.121121	0.152709	-1.321811
C	-2.380391	-0.992944	-2.559827
C	-3.109584	-1.141467	-1.494139
C	-2.007509	2.105141	-1.080241
C	-1.279408	2.256398	-2.145008
C	-2.736610	1.959593	-0.015364
C	-1.582950	-0.395423	2.858288
C	3.022903	-0.248949	2.033716
C	2.093547	0.353410	-2.514769
C	-3.129849	1.446613	-1.147311
C	-2.400657	1.595136	-2.212996