123
energy: -582.678996
C	-2.618332	-0.281185	1.180436
C	2.044731	0.363736	0.209260
C	2.489826	-0.199198	-1.492596
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C	1.981833	-1.396272	-1.557554
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C	-2.775744	1.001419	1.030778
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C	-0.085629	1.644740	-2.284113
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C	-1.639194	-1.923735	-2.469192
C	-1.934759	2.179588	-1.129683
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C	0.901416	-0.982832	-0.971321
C	0.145203	-1.569535	2.348602
C	-0.651668	0.696583	1.699476
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C	-0.794469	1.973632	1.552200
C	1.325433	-0.394536	-2.056725
C	0.958514	0.767611	0.791729
C	0.819371	2.048492	0.651339
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C	0.758417	1.202978	-1.413473
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C	1.471957	-2.591280	-1.622246
C	-2.294224	-0.290901	-1.051686
C	0.334577	0.608899	-0.325435
C	-1.540152	-1.324842	-1.322016
C	-1.650165	2.427183	0.681276
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C	0.564275	-0.975654	1.261800
C	-0.030028	-2.766118	0.047637
C	-1.079222	1.736429	-0.258032
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C	1.242961	2.643160	-0.429481
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C	-0.599921	-1.165797	0.705404
C	-1.875878	0.299237	-2.134467
C	1.836699	0.800143	-1.996695
C	-0.926942	0.457753	-0.111196
C	1.410133	0.209342	-0.911133
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C	-1.776961	-0.724712	2.060796
C	-1.200367	-2.945777	-0.510721
C	0.397718	1.457776	1.734542
C	-1.350591	-0.134115	0.975166
C	0.986306	-0.382978	0.175080
C	1.558442	-1.984340	-0.475497
C	1.051747	-3.179997	-0.542705
C	-0.604966	0.453775	-2.345499
C	-1.925302	0.558012	1.909863
C	2.063883	-0.787878	-0.410749
C	-2.353392	1.590071	-0.048965
C	-2.075163	1.837457	1.759049
C	-2.395128	-0.891601	-2.200609
C	0.812375	-1.585924	-2.116477
C	-2.718083	-0.880667	0.029151
C	-0.504829	1.050749	-1.197543
C	1.139556	-2.576261	0.606212
C	0.615251	2.477666	-1.555035
C	-0.022291	0.870618	2.820853
C	-0.229099	1.288034	0.613232
C	-1.871663	-1.320820	0.908600
C	1.806657	1.954340	-1.376076
C	-1.963175	-1.916511	-0.241533
C	-1.215455	1.390653	2.633778
C	-2.059368	-2.512412	-1.389738
C	1.622905	-0.227213	1.292892
C	0.303879	-2.777715	-2.178579
C	0.046446	3.158520	-0.608015
C	1.590080	0.931505	1.909594
C	2.010605	1.520633	0.829311
C	0.254815	2.741747	1.594361
C	0.681073	3.331044	0.517252
C	1.444198	2.221500	1.773663
C	1.868148	2.810255	0.695015
C	2.432149	2.110504	-0.249382
C	2.709525	-0.636662	0.707535
C	3.131850	-0.047110	-0.371679
C	2.682645	0.518161	1.326857
C	3.104593	1.108537	0.248057
C	-0.159488	2.153438	2.676663
C	1.027390	1.632374	2.854890
C	1.170993	0.343712	2.990385
C	2.290877	-1.225251	1.788708
C	2.721927	-1.789612	0.083606
C	3.145006	-1.201250	-0.993878
C	2.305167	-2.377814	1.163643
C	2.217711	-2.989458	0.015276
C	2.638019	-2.400621	-1.064517
C	-0.937871	3.252706	1.408711
C	1.183503	1.799415	-2.503646
C	-0.936581	-1.170681	2.942643
C	-3.041814	0.744117	-0.778253
C	-3.464139	0.157798	0.300672
C	-2.624283	1.334394	-1.856888
C	-3.567262	-0.446665	-0.849992
C	-3.146998	0.142121	-1.929652
C	2.263674	-0.069523	2.408287