%chk=000260120.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260120

0 1
O 3.336505 -3.262036 1.205124
O -2.230119 -4.542269 -0.449771
O -0.252188 -4.414497 0.380311
O -2.853605 3.754500 0.217215
O -4.307711 2.034349 -0.205121
N 4.019550 -0.115772 -0.533317
N 0.773683 -2.170545 1.120993
N -2.856344 -0.445919 -0.178338
N -1.301689 -3.878206 0.016948
N -2.026506 1.705844 0.419498
N -3.741979 -2.475808 -0.794113
C 3.240361 -1.828747 1.193331
C 3.481027 -1.477584 -0.293047
C 1.863989 -1.383204 1.733774
C 3.083736 0.957119 -0.318147
C -0.400042 -1.623260 0.684676
C 5.385794 0.083957 0.018817
C -1.447058 -2.470152 0.137385
C -0.623419 -0.232010 0.775125
C 1.929308 0.980471 -1.134514
C 3.307666 2.007983 0.590560
C -2.671122 -1.809970 -0.273244
C -1.844681 0.306386 0.337568
C 1.036080 2.044013 -1.046073
C 2.398693 3.068165 0.666041
C 1.261075 3.091085 -0.141888
C -3.208977 2.415209 0.091295
C -3.893259 4.739509 -0.093791
C -4.094418 4.828807 -1.590329
H 4.042641 -1.412511 1.845085
H 4.198462 -2.223355 -0.717015
H 2.544091 -1.610127 -0.880405
H 1.730710 -0.285749 1.552536
H 1.820704 -1.523054 2.839652
H 0.987702 -3.181274 0.971672
H 5.791619 1.037015 -0.364949
H 5.447995 0.092254 1.116982
H 6.043503 -0.718258 -0.359251
H 3.282957 -3.613711 2.116728
H 0.159484 0.417338 1.159903
H 1.752868 0.177990 -1.850209
H 4.185892 2.017771 1.229501
H 0.156986 2.063727 -1.691990
H 2.585158 3.883837 1.364635
H 0.566435 3.926271 -0.089379
H -1.211769 2.267057 0.712202
H -4.575332 -1.961250 -1.058073
H -3.736091 -3.490190 -0.920800
H -3.439275 5.647801 0.344796
H -4.814546 4.456774 0.446404
H -3.144858 4.976434 -2.120718
H -4.546959 3.906474 -1.988312
H -4.759031 5.659221 -1.857761


%chk=000260120-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260120

0 1
O 2.819447 -3.214459 2.010804
O -1.845550 -4.202483 -1.552148
O 0.108056 -3.993123 -0.414617
O -3.806467 3.553258 1.223985
O -4.957141 1.888973 0.010065
N 4.302904 -0.228965 0.360944
N 0.688233 -1.803765 0.852000
N -3.128676 -0.372523 -0.361689
N -1.048307 -3.486819 -0.791602
N -2.714832 1.637515 0.822319
N -3.612182 -2.293543 -1.532358
C 2.951471 -1.758421 1.828343
C 3.805314 -1.599256 0.544162
C 1.571469 -1.068098 1.757401
C 3.755765 0.667446 -0.580640
C -0.548953 -1.359362 0.461500
C 5.555236 0.117929 1.047845
C -1.429710 -2.176556 -0.371640
C -1.022871 -0.080350 0.855348
C 2.529181 0.395256 -1.266524
C 4.416842 1.902356 -0.872241
C -2.719722 -1.615791 -0.753733
C -2.297462 0.356078 0.417989
C 2.006851 1.311975 -2.200661
C 3.875703 2.811035 -1.805248
C 2.668038 2.530133 -2.482595
C -3.936555 2.286652 0.601538
C -4.985560 4.454662 1.090860
C -4.932553 5.237212 -0.224298
H 3.510021 -1.308391 2.677354
H 4.658219 -2.296549 0.642657
H 3.230437 -1.933288 -0.334869
H 1.726488 -0.028108 1.407814
H 1.124036 -1.011392 2.775488
H 0.922934 -2.780138 0.593075
H 6.409652 0.205667 0.343764
H 5.466766 1.074792 1.598079
H 5.799750 -0.669402 1.779591
H 2.345719 -3.411737 2.858475
H -0.405768 0.564583 1.483648
H 1.972724 -0.527082 -1.075580
H 5.361492 2.154537 -0.382569
H 1.066329 1.068294 -2.708516
H 4.412164 3.745945 -2.006693
H 2.253983 3.237060 -3.208629
H -2.045727 2.193733 1.359047
H -4.490518 -1.819210 -1.740605
H -3.359429 -3.231800 -1.863104
H -4.907732 5.114516 1.969946
H -5.903220 3.843455 1.155878
H -3.988799 5.803211 -0.309175
H -5.021661 4.556220 -1.087319
H -5.772135 5.956021 -0.264667


