%chk=000223038.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223038

0 1
O -3.782135 1.108308 -0.731430
O -4.498281 -1.683032 -0.108468
O 4.307852 -0.333346 0.945522
O 3.327931 1.575744 0.231783
N 2.276576 -2.868577 1.308633
C -0.850268 1.833488 -0.444551
C 0.646990 1.594447 -0.165162
C -1.498003 0.507595 -0.171866
C -0.537417 -0.466278 0.222314
C 0.789443 0.146472 0.252613
C -2.847431 0.182153 -0.276382
C -0.947351 -1.776613 0.499055
C 1.990083 -0.408019 0.586868
C -3.246544 -1.157105 -0.015529
C -2.289697 -2.119770 0.376027
C 3.225708 0.406569 0.548611
C 2.143701 -1.765091 0.983988
C -4.109338 2.135528 0.243772
C -5.584280 -0.843961 -0.587785
C 5.622481 0.315374 0.934845
C 6.152207 0.374738 -0.481717
H -1.029700 2.153941 -1.490467
H -1.267711 2.634652 0.194781
H 1.045694 2.275587 0.616995
H 1.281261 1.814498 -1.051324
H -0.229532 -2.540770 0.806049
H -2.627681 -3.137855 0.575401
H -3.228922 2.749066 0.457222
H -4.505449 1.683601 1.156491
H -4.874834 2.715732 -0.284239
H -5.306648 -0.351027 -1.527129
H -5.842480 -0.110074 0.179402
H -6.383025 -1.581223 -0.733819
H 5.527462 1.312383 1.399629
H 6.188967 -0.375965 1.586645
H 7.200011 0.696013 -0.505611
H 6.091472 -0.605134 -0.974470
H 5.573888 1.082352 -1.094297


%chk=000223038-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223038

0 1
O -3.808137 1.275223 -0.597645
O -4.579939 -1.540504 0.022483
O 4.376208 -0.339891 0.911142
O 3.426985 1.644560 0.123272
N 2.191978 -2.814533 1.403828
C -0.871009 1.949841 -0.431367
C 0.650880 1.712585 -0.216173
C -1.504231 0.610838 -0.121884
C -0.528228 -0.349882 0.281504
C 0.801344 0.267555 0.257649
C -2.868919 0.282896 -0.203460
C -0.948062 -1.669878 0.623544
C 2.025803 -0.315193 0.592075
C -3.275624 -1.055508 0.085606
C -2.304190 -2.004354 0.516786
C 3.298192 0.449154 0.503222
C 2.123491 -1.677010 1.035309
C -4.379659 2.024039 0.542991
C -5.544709 -0.975376 -0.946734
C 5.729077 0.290067 0.845830
C 6.336161 0.121511 -0.549949
H -1.107682 2.272118 -1.461391
H -1.253740 2.746081 0.234714
H 1.096290 2.410944 0.513293
H 1.236644 1.872579 -1.139048
H -0.232826 -2.427556 0.948580
H -2.656382 -3.014309 0.746398
H -3.584286 2.532875 1.120383
H -4.943686 1.350101 1.217262
H -5.056221 2.771384 0.101084
H -5.058062 -0.773229 -1.915672
H -5.997722 -0.045324 -0.566921
H -6.311514 -1.758375 -1.052673
H 5.635755 1.356059 1.118797
H 6.301033 -0.253549 1.614388
H 7.371452 0.510439 -0.555488
H 6.364693 -0.943212 -0.838359
H 5.753842 0.681234 -1.300974


