104
energy: -483.046039
C	-1.767616	-1.908451	1.114669
C	0.021177	0.535570	1.771259
C	1.138765	1.258566	-0.050023
C	-2.227737	-0.341929	-0.443379
C	-1.342874	1.259680	-0.186087
C	0.343062	-2.711861	0.061008
C	1.422911	-2.550063	0.790117
C	0.727772	-1.737130	-0.715404
C	-2.584288	0.884463	-0.178835
C	-1.697293	2.481389	0.077254
C	0.364722	-0.687907	1.508988
C	1.303389	2.350294	1.403308
C	2.450526	0.118791	1.364978
C	-1.683199	-2.090352	-0.169098
C	-0.326501	1.759864	2.035112
C	0.916855	1.380376	2.178671
C	0.249266	-2.527109	1.344069
C	0.532381	0.411395	2.956226
C	-1.377246	-0.934653	0.336052
C	-0.907702	-0.144786	-1.723512
C	0.330074	0.242707	-1.720169
C	-0.923265	-2.506429	1.898458
C	-0.990221	0.038657	-0.443381
C	-1.729441	0.287608	0.592487
C	1.157969	-1.687899	1.743971
C	1.114334	-0.765054	-1.493985
C	1.927441	0.256799	0.185528
C	1.540889	-0.715264	0.964089
C	-1.294262	-1.116859	-0.944941
C	1.407578	0.395324	-0.994635
C	0.283742	2.614965	-0.971462
C	0.629320	1.398242	-1.228725
C	0.407733	1.507641	0.992692
C	-2.081744	1.511251	0.853220
C	2.039261	2.092083	0.357591
C	-1.221001	0.910679	1.621716
C	-0.834832	1.881761	0.843934
C	2.719441	-0.743535	0.421875
C	-0.831614	-2.680224	0.616278
C	-0.959507	2.233197	-0.964495
C	0.241288	0.422492	-0.447220
C	-0.876533	-0.309496	1.366838
C	-1.265661	-1.281193	2.149164
C	-1.609212	-0.057695	2.401970
C	1.806977	-1.580096	0.014109
C	2.335452	-1.713549	1.198232
C	-2.468273	0.542654	1.630073
C	-0.488835	0.663975	0.586275
C	-0.057041	-0.730563	-0.940430
C	1.020370	-0.577954	-0.214963
C	0.058791	2.730124	1.259732
C	-0.101878	1.638469	-0.193382
C	0.751651	0.285383	0.729509
C	-0.450657	2.855636	0.068543
C	-0.603180	1.011832	-1.222971
C	0.633418	-1.551414	0.564599
C	0.882905	-0.815861	2.686657
C	-0.712168	0.791392	2.812539
C	-2.119225	-0.683059	1.371266
C	2.066426	-0.850373	2.142193
C	1.267049	0.153098	1.909826
C	-0.020163	-1.660922	2.291301
C	-2.971261	-0.084887	0.597049
C	2.317707	1.228489	-0.591884
C	2.192707	-0.610122	-0.762786
C	-0.146134	-0.551747	0.333093
C	1.652717	1.122962	1.133032
C	1.528455	2.233321	-0.827778
C	-0.444092	-1.704045	-0.160926
C	0.795021	2.481711	0.216934
C	-0.364675	-0.434536	2.552675
C	-2.614162	-1.311222	0.331941
C	-1.842047	0.627947	-1.220181
C	-0.534158	-1.527482	1.114625
C	-2.200216	1.854025	-0.955894
C	-0.218973	1.985816	-2.004431
C	-1.457746	1.596757	-1.997164
C	-0.523433	0.826058	-2.504980
C	1.798054	1.367519	-1.775332
C	0.717174	1.214432	-2.503141
C	1.018700	2.376875	-2.012828
C	-0.354825	-1.886311	-1.441515
C	0.030902	-0.916321	-2.218422
C	1.502837	0.204565	-2.274901
C	2.579488	0.358313	-1.539344
C	1.899759	-1.773760	-1.271330
C	1.515489	-2.744010	-0.495396
C	0.824083	-1.926122	-1.995624
C	-0.740320	-2.856490	-0.666457
C	-1.569643	2.132076	1.882562
C	-1.185576	3.102054	1.108120
C	-1.955870	1.165023	2.659583
C	2.286462	-0.805263	-2.048238
C	2.837322	1.088262	0.589489
C	3.106417	0.225214	-0.354578
C	-2.146074	-0.532305	-1.730131
C	-2.532823	-1.501854	-0.954680
C	-1.214412	-1.300757	-2.226961
C	-1.600250	-2.271048	-1.451839
C	0.438782	-2.896526	-1.220377
C	-1.761895	0.436807	-2.507403
C	0.416264	0.051930	-2.995949
C	-0.829280	-0.332266	-3.004682
C	1.209760	-0.957758	-2.773227