93
energy: -424.297294
C	1.166751	0.519059	-1.794790
C	-0.236504	-1.175208	2.061675
C	-1.306479	0.260326	0.696469
C	0.105762	-0.951466	-2.096620
C	1.452933	0.146414	2.746359
C	-2.044122	-1.185203	-0.864067
C	-0.031193	0.161311	-1.438449
C	-1.228790	-0.196605	-1.082308
C	-1.110766	-1.508093	1.159214
C	-0.295782	-0.519182	0.940720
C	-1.092187	-1.309540	-1.740731
C	2.728105	0.046934	0.610506
C	1.303953	-0.593856	-2.453353
C	-0.432216	0.593121	1.598688
C	1.530232	-0.310237	0.966921
C	1.666321	-1.421843	0.309018
C	2.177986	-0.261158	-1.550693
C	-1.985347	-1.841351	0.256800
C	-0.905363	-0.171629	-2.341074
C	1.853471	-0.285349	-0.291735
C	1.393686	0.802025	1.624923
C	-2.180488	-0.072567	-0.205950
C	-0.372861	-0.062177	2.720412
C	0.706279	1.606462	0.122025
C	-0.974024	-2.621420	0.501250
C	0.851468	-2.412095	0.527146
C	-1.032959	-1.965006	-0.619663
C	1.726299	-2.079865	1.428403
C	0.578526	-0.186527	1.842934
C	-0.218103	-0.976054	-0.837972
C	0.519358	0.469195	0.722394
C	-1.169818	-0.852146	0.038382
C	1.990731	-1.398072	-0.950499
C	0.155718	1.298844	-2.039167
C	0.714956	-1.298710	1.184950
C	1.030119	1.631806	-1.136534
C	0.441992	0.926126	2.502069
C	-0.080570	-2.089374	-1.495941
C	-1.247404	-0.395347	1.817482
C	2.864635	-1.066669	-0.048034
C	2.040988	0.851915	-0.892285
C	2.541639	-1.090802	1.211076
C	-0.159069	-1.631448	0.282691
C	0.774695	-1.955734	2.305858
C	0.979420	-0.618111	-1.193961
C	1.117373	-1.731274	-1.852314
C	-0.491374	1.248833	0.478135
C	0.382979	1.581564	1.380596
C	-1.041944	0.940823	-1.682694
C	2.404982	0.022427	1.869658
C	-1.365470	0.915991	-0.424187
C	0.655767	-0.642772	0.064491
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C	-0.167828	1.273803	-0.780398
C	1.589473	-0.966524	2.087330
C	0.792845	-1.755054	-0.593114
C	0.842821	0.494258	-0.536086
C	-0.354825	0.136446	-0.179950
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C	-2.121796	-0.728307	0.914854
C	0.637821	-0.842519	2.964635
C	-0.099654	-2.288416	1.403462
C	1.717003	0.826797	0.366298
C	3.052306	0.071494	-0.648246
C	1.581117	1.940017	1.024602
C	2.591986	1.160240	1.268993
C	1.904673	1.964988	-0.233612
C	2.915710	1.184959	0.010170
C	-1.443121	1.372897	1.354803
C	-2.258799	0.384335	1.573409
C	-1.384087	0.717379	2.476317
C	-2.317545	1.039950	0.452158
C	-0.568704	1.706071	2.257930
C	-1.502403	2.028925	0.233967
C	-0.627733	2.361870	1.136810
C	-0.304320	2.386512	-0.122257
C	-1.178745	2.053559	-1.024906
C	0.570338	2.719891	0.780567
C	0.019212	2.411925	-1.381253
C	0.893897	2.744948	-0.478303
C	-2.239622	0.583036	-1.326630
C	-2.103569	-0.529501	-1.985188
C	-2.376998	1.695859	-0.668883
C	-2.996783	-1.061390	0.012322
C	-3.133503	0.051304	0.670513
C	-3.055810	-0.405537	-1.108624
C	-3.192526	0.707056	-0.450510
C	1.806070	-2.534386	-0.346714
C	0.932411	-2.868498	-1.249602
C	-0.718783	0.966183	-2.942328
C	-1.916753	0.608296	-2.586027
C	-0.855482	2.078904	-2.284166
C	-2.053456	1.720917	-1.927927