%chk=000246663.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246663

0 1
O 0.148657 -3.447147 0.627307
O 6.606795 3.012411 0.371059
O -7.157951 2.990717 -1.689319
O 7.270815 1.135166 1.389645
O -6.978156 2.814544 0.533086
N 1.045285 -2.216942 -1.131137
N -1.049175 -1.623298 -0.133699
C 3.899357 -0.888494 -0.642259
C -4.012296 -0.390276 -0.161034
C 3.325664 -2.171596 -0.030684
C -3.094094 -0.796830 0.998332
C 4.901374 -0.225446 0.310511
C -4.858365 0.833144 0.210399
C 2.357377 -2.900473 -0.973631
C -2.237511 -2.025942 0.670793
C 5.464641 1.067732 -0.288696
C -5.784296 1.237959 -0.941344
C 0.057617 -2.503389 -0.143570
C 6.527587 1.651547 0.591281
C -6.662917 2.386819 -0.550512
H 4.391516 -1.119839 -1.607581
H 3.081783 -0.181020 -0.878936
H -4.671599 -1.238722 -0.432403
H -3.411941 -0.173396 -1.065055
H 2.816026 -1.948820 0.929433
H 4.150545 -2.863258 0.237016
H -3.702437 -1.018886 1.899177
H -2.442114 0.052480 1.289821
H 5.733582 -0.923725 0.542752
H 4.418400 -0.010257 1.285318
H -4.202973 1.684746 0.484243
H -5.461881 0.624511 1.119250
H 2.171772 -3.934546 -0.588767
H 2.793037 -3.008050 -1.991696
H -1.870956 -2.505601 1.612471
H -2.832537 -2.801741 0.139855
H 5.901898 0.878899 -1.295030
H 4.657232 1.813894 -0.459486
H -5.200890 1.498766 -1.852091
H -6.428905 0.383871 -1.249680
H 1.124573 -1.253141 -1.455139
H -1.253925 -1.056176 -0.951303
H 7.308988 3.451800 0.919798
H -7.762203 3.753806 -1.489493


%chk=000246663-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246663

0 1
O -0.162233 -3.713877 1.087113
O 5.668300 3.572840 -0.960403
O -5.388988 4.068821 -0.881955
O 5.867987 2.563269 1.120593
O -5.580758 3.104664 1.221206
N 1.044980 -2.804767 -0.702525
N -1.309650 -2.687166 -0.678513
C 3.483609 -0.855917 -0.424922
C -3.559719 -0.521972 -0.369360
C 3.092823 -1.992901 0.544932
C -3.256430 -1.688550 0.596877
C 4.251020 0.286492 0.276298
C -4.225112 0.678196 0.339576
C 2.352356 -3.169219 -0.134829
C -2.635476 -2.928559 -0.088654
C 4.633921 1.413879 -0.701182
C -4.525756 1.834686 -0.632674
C -0.143333 -3.102597 -0.027574
C 5.436325 2.524260 -0.051558
C -5.205612 3.015446 0.032461
H 4.107724 -1.271136 -1.245367
H 2.567470 -0.443748 -0.898803
H -4.222186 -0.883730 -1.185034
H -2.616880 -0.185153 -0.850117
H 2.454760 -1.594884 1.357508
H 4.008599 -2.394954 1.025008
H -4.197483 -2.005946 1.091616
H -2.573876 -1.347310 1.398998
H 5.166269 -0.112743 0.753291
H 3.635796 0.701108 1.097545
H -3.570929 1.041451 1.155029
H -5.164645 0.352935 0.825518
H 2.156312 -3.960879 0.608569
H 2.985298 -3.599036 -0.937074
H -2.499614 -3.731957 0.655718
H -3.317525 -3.303464 -0.878346
H 5.234783 1.017594 -1.544457
H 3.736754 1.868547 -1.164456
H -3.600542 2.204182 -1.116775
H -5.178983 1.495736 -1.461554
H 1.019234 -2.308358 -1.593297
H -1.252348 -2.195242 -1.570323
H 6.204421 4.280860 -0.509630
H -5.843264 4.824898 -0.419471


