%chk=000238027.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238027

0 1
P -0.028939 0.345773 0.068900
P 1.470380 -1.829060 -1.179009
P 2.168316 -0.984059 1.549067
N 0.995758 0.222400 1.405254
N 0.347150 -0.579183 -1.301581
N 2.562669 -1.760437 0.099833
N 2.419146 -1.973689 -2.660709
N 0.618368 -3.372745 -1.044003
N 3.617854 -0.293825 2.268411
N 1.700525 -2.146590 2.792805
C -0.116317 2.115347 -0.439604
C -1.757874 -0.046070 0.605923
C 0.120505 3.103754 0.513987
C -2.684137 -0.484794 -0.337387
C -0.415693 2.430928 -1.763580
C -2.096750 0.101683 1.949343
C 2.159243 -0.889764 -3.646149
C -0.428219 -3.549734 -2.087264
C 4.435716 0.441200 1.264886
C 0.396264 -2.798543 2.498728
C 0.043959 4.448973 0.130442
C -3.990306 -0.777460 0.076043
C -0.490616 3.778084 -2.140036
C -3.404197 -0.192609 2.357300
C -0.263399 4.782367 -1.192866
C -4.347092 -0.629151 1.420637
H 3.442030 -2.051696 -2.478660
H 1.250836 -4.196718 -1.034076
H 3.403109 0.327273 3.076835
H 2.427054 -2.866326 2.977052
H 0.373279 2.850047 1.549141
H -2.410616 -0.612010 -1.388883
H -0.582849 1.650577 -2.512697
H -1.361744 0.434872 2.691101
H 1.075009 -0.796363 -3.852557
H 2.648034 -1.159931 -4.598380
H 2.519335 0.109245 -3.347542
H -1.030671 -4.439591 -1.834527
H -0.043421 -3.681811 -3.112948
H -1.123182 -2.687110 -2.091516
H 3.962054 1.341027 0.837263
H 4.719569 -0.233389 0.431623
H 5.378780 0.753983 1.747638
H 0.354263 -3.395330 1.569110
H -0.416041 -2.047502 2.468654
H 0.147362 -3.478315 3.333235
H 0.223884 5.233305 0.862026
H -4.726087 -1.120044 -0.647465
H -0.725070 4.042848 -3.168287
H -3.685142 -0.081533 3.402150
H -0.324644 5.829009 -1.487704
H -5.363343 -0.855816 1.739845


%chk=000238027-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238027

0 1
P -0.271500 0.192373 0.085916
P 1.320398 -1.855415 -1.328006
P 2.065719 -1.009049 1.466210
N 0.605153 -0.099689 1.538520
N 0.112517 -0.634910 -1.380088
N 2.356380 -1.909922 0.038578
N 2.115645 -1.672932 -2.849697
N 0.796899 -3.504501 -1.492389
N 3.563902 -0.176720 1.752254
N 2.034283 -1.897004 2.952960
C -0.165453 2.013758 -0.323310
C -2.058413 -0.148018 0.507027
C 0.147054 2.938762 0.698669
C -2.957926 -0.525416 -0.515693
C -0.398169 2.450346 -1.648038
C -2.494594 -0.024584 1.846256
C 2.441311 -0.375323 -3.453625
C -0.217310 -3.924201 -2.471051
C 4.411272 0.336084 0.666968
C 0.817697 -2.506425 3.506552
C 0.223553 4.316356 0.390508
C -4.311245 -0.776350 -0.192803
C -0.321944 3.829038 -1.949068
C -3.848998 -0.275954 2.161905
C -0.015105 4.762459 -0.930617
C -4.758187 -0.647758 1.143313
H 2.645327 -2.492733 -3.152880
H 0.895241 -4.053784 -0.635545
H 3.634838 0.278584 2.665146
H 2.931695 -2.315664 3.208268
H 0.350356 2.568509 1.710187
H -2.585935 -0.642966 -1.540123
H -0.611993 1.710200 -2.427633
H -1.769619 0.242743 2.623447
H 1.722605 0.371120 -3.074960
H 2.328621 -0.429029 -4.552435
H 3.469899 -0.030150 -3.219721
H -1.256310 -3.825692 -2.093747
H -0.044470 -4.975904 -2.765535
H -0.121937 -3.296928 -3.374073
H 4.181470 1.385150 0.386685
H 4.257145 -0.310478 -0.214261
H 5.475986 0.271657 0.957509
H 0.660393 -3.553838 3.173794
H -0.046866 -1.900398 3.187722
H 0.858387 -2.490421 4.611206
H 0.469235 5.038845 1.177056
H -5.014125 -1.072541 -0.979682
H -0.498901 4.174482 -2.973906
H -4.193895 -0.184337 3.198044
H 0.042414 5.831351 -1.166454
H -5.808398 -0.841286 1.390442


