168
/NpBn NpBn-geopt
Np	0.042510	3.396252	15.330852
C	-2.014344	2.753651	13.995597
H	-2.514445	3.733939	13.938470
H	-1.711056	2.432747	12.990009
C	-2.798706	1.749762	14.711616
C	-2.774197	0.376851	14.349555
H	-2.175533	0.072661	13.486987
C	-3.515531	-0.578008	15.041690
H	-3.481406	-1.621815	14.717674
C	-4.309945	-0.214967	16.137822
H	-4.897424	-0.963367	16.673021
C	-4.341572	1.130554	16.524375
H	-4.954388	1.438307	17.375966
C	-3.601822	2.088174	15.833283
H	-3.654444	3.133462	16.145863
P	2.364740	2.696535	12.564138
N	1.521512	3.193544	13.791667
N	2.973364	1.112595	12.577687
N	3.930720	3.373416	12.284073
N	1.494707	2.837286	11.123913
C	4.433129	1.052429	12.503968
H	4.767371	0.742944	11.494573
H	4.842032	0.331115	13.228283
C	4.939473	2.455763	12.830753
H	5.056107	2.562903	13.924666
H	5.917823	2.631246	12.360446
C	2.212712	-0.107416	12.967292
C	2.383774	-0.368157	14.476361
H	3.445077	-0.499822	14.736078
H	1.849021	-1.280635	14.778895
H	1.988070	0.477289	15.056997
C	2.742667	-1.304099	12.154476
H	2.640631	-1.114518	11.075921
H	2.161894	-2.203705	12.403266
H	3.798067	-1.521038	12.371450
C	0.719601	0.057181	12.646080
H	0.283085	0.913030	13.177135
H	0.184922	-0.848621	12.963957
H	0.558347	0.201815	11.569774
C	4.184636	4.837142	12.473418
C	4.401334	5.193920	13.957855
H	3.525806	4.898057	14.550460
H	4.552308	6.277293	14.065398
H	5.291348	4.696853	14.368879
C	5.432693	5.217868	11.655712
H	6.340117	4.723487	12.030031
H	5.601020	6.302808	11.718298
H	5.299834	4.946409	10.598636
C	2.991224	5.643438	11.936752
H	2.808056	5.428421	10.876606
H	3.206656	6.715973	12.040213
H	2.078341	5.423525	12.506424
C	2.056977	2.296303	9.880116
H	1.280045	1.694512	9.376180
H	2.851961	1.592551	10.160101
C	2.611866	3.340305	8.908326
H	2.954711	2.848800	7.985731
H	3.465318	3.867182	9.355456
H	1.851063	4.082676	8.625023
P	1.325965	1.806274	18.458450
N	0.733064	2.459985	17.155373
N	3.008901	1.466437	18.579736
N	0.897354	0.191409	18.799267
N	0.997440	2.753920	19.816098
C	3.228878	0.053792	18.241871
H	4.181525	-0.299071	18.662245
H	3.247910	-0.116883	17.149674
C	2.055667	-0.702221	18.863755
H	1.876353	-1.632092	18.303037
H	2.280324	-0.978775	19.911537
C	4.054313	2.438187	18.128963
C	4.278149	2.374030	16.605107
H	4.640081	1.384593	16.290024
H	5.039140	3.112548	16.313373
H	3.350676	2.593992	16.057752
C	5.367158	2.101850	18.862452
H	5.209399	2.101133	19.950581
H	6.130512	2.855640	18.620858
H	5.769421	1.122704	18.566547
C	3.645407	3.868083	18.512902
H	2.714623	4.163741	18.012644
H	4.437993	4.561792	18.198263
H	3.504941	3.962989	19.597582
C	-0.450101	-0.390956	18.530824
C	-0.544568	-0.866995	17.069450
H	-0.403698	-0.017350	16.388709
H	-1.529429	-1.307442	16.864019
H	0.223073	-1.623753	16.846665
C	-1.541800	0.656633	18.801944
H	-1.519034	0.989547	19.848556
H	-2.524028	0.213282	18.592527
H	-1.430594	1.529993	18.146748
C	-0.678301	-1.577444	19.486120
H	0.032810	-2.397048	19.310929
H	-1.689756	-1.978808	19.331460
H	-0.588470	-1.260895	20.535504
C	1.467514	2.313494	21.135081
H	1.922705	3.176393	21.653173
H	2.285370	1.600548	20.963556
C	0.398082	1.681669	22.029119
H	0.002337	0.767343	21.567906
H	-0.441421	2.367855	22.214191
H	0.832384	1.416959	23.004720
C	0.009206	3.834424	19.764057
H	-0.948957	3.510821	20.214396
H	-0.187552	4.023482	18.700949
C	0.479464	5.123825	20.438548
H	1.409387	5.490063	19.980450
H	0.654353	4.995971	21.516634
H	-0.292734	5.898559	20.323829
P	-0.813282	6.977307	15.826759
N	-0.403218	5.471802	15.646001
N	-2.040674	7.334877	16.957831
N	0.282257	8.088337	16.551444
N	-1.217732	7.677500	14.346712
C	-1.569642	8.172776	18.061518
H	-1.972949	9.199193	17.974014
H	-1.885330	7.771453	19.037460
C	-0.043144	8.183426	17.981735
H	0.369520	7.335365	18.558078
H	0.356982	9.114623	18.406953
C	-3.277311	6.523567	17.137834
C	-3.769181	6.013809	15.773513
H	-4.012705	6.847741	15.103043
H	-4.674276	5.406319	15.913474
H	-3.011084	5.385909	15.289179
C	-3.000952	5.324899	18.067443
H	-2.229834	4.679274	17.625838
H	-3.912469	4.729261	18.225826
H	-2.645498	5.658652	19.053873
C	-4.377642	7.416456	17.739977
H	-4.123718	7.768505	18.749538
H	-5.312911	6.843963	17.814656
H	-4.560000	8.293848	17.102286
C	1.738441	8.098981	16.195037
C	1.899390	7.969930	14.673772
H	1.549589	6.992372	14.318775
H	2.964397	8.063177	14.420567
H	1.345298	8.757595	14.146634
C	2.502745	6.948799	16.880441
H	2.477573	7.036071	17.976017
H	3.558381	6.955770	16.572802
H	2.060692	5.984168	16.597732
C	2.325475	9.455507	16.627473
H	1.754876	10.281490	16.179089
H	3.369861	9.529834	16.291823
H	2.324436	9.580634	17.719213
C	-1.549673	9.105988	14.278670
H	-0.979803	9.560544	13.448535
H	-1.166406	9.569439	15.197735
C	-3.037594	9.422493	14.112680
H	-3.459284	8.959488	13.208494
H	-3.181250	10.509751	14.025583
H	-3.608836	9.069625	14.981771
C	-1.469810	6.857994	13.156670
H	-1.183978	5.831781	13.423085
H	-2.552165	6.837647	12.927197
C	-0.691758	7.302971	11.917156
H	-0.913734	6.621407	11.083077
H	0.391258	7.277914	12.099360
H	-0.964732	8.317815	11.592735
C	0.299733	3.678609	11.017126
H	0.532275	4.616580	10.477520
H	0.029898	3.961869	12.042976
C	-0.884100	2.983979	10.342340
H	-0.699017	2.781225	9.277373
H	-1.773587	3.627122	10.406908
H	-1.119111	2.031855	10.838217