44
energy: -176.981633
C	-0.379332	1.157411	1.180018
C	-0.851142	0.012775	0.783825
C	1.403641	2.206985	0.289987
C	0.151453	1.674988	-0.946046
C	0.459369	-0.082757	-0.501664
C	1.593258	-0.350686	-1.078731
C	1.563660	-0.037006	0.182808
C	2.036078	1.108077	0.578821
C	0.931072	1.061338	-0.105518
C	1.061983	-0.867963	1.048474
C	1.534398	0.276768	1.444321
C	1.091764	-1.181650	-0.213294
C	0.429790	0.231050	0.759268
C	0.960639	0.747973	-1.367083
C	-0.320523	0.529754	-1.342235
C	0.122056	1.988702	0.314542
C	-0.042174	-0.913299	0.363426
C	-0.349853	0.843318	-0.081057
C	0.901873	1.375846	1.155690
C	0.400484	0.544392	2.021207
C	-0.071335	-0.599843	1.624847
C	-0.821811	-0.300803	-0.477041
C	1.432970	1.893273	-0.970630
C	2.065495	0.794316	-0.682480
C	-0.012726	-1.226673	-0.896563
C	0.488204	-0.397525	-1.763275
C	0.590203	-2.012755	0.651511
C	1.121639	-1.495596	-1.474980
C	0.618433	-2.326545	-0.610921
C	-0.514695	-2.058501	-0.032827
C	-1.323352	-1.131786	0.387621
C	-0.543289	-1.744321	1.229112
C	-0.793273	-0.614740	-1.738733
C	-1.293775	-1.446015	-0.874468
C	-1.631155	0.625318	-0.056713
C	-1.129859	1.456741	-0.921886
C	-1.602316	0.311689	-1.318269
C	-1.159297	1.770523	0.339392
C	-2.103488	-0.519676	-0.453461
C	-0.881371	0.326733	2.045573
C	-1.661103	0.939287	1.204778
C	-1.353393	-0.817896	1.649325
C	-2.133164	-0.205483	0.808414
C	0.013966	-1.545737	-2.155081