%chk=000293142.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293142

0 1
S 3.155164 -1.008371 -0.335939
O 3.665625 -0.719896 1.004445
O 3.554947 -2.256507 -0.956855
O -3.125562 1.233140 1.003574
O 3.344382 1.827574 1.326072
N 3.744405 0.208899 -1.398743
N -2.753305 -0.514888 -0.451508
C 1.454513 -0.830831 -0.361594
C -5.084839 0.203294 -0.023580
C -1.335399 -0.585003 -0.393455
C 0.685521 -1.658669 -1.191674
C 0.818625 0.117077 0.453875
C -3.588085 0.395885 0.263591
C 3.473846 1.628220 -1.093340
C -0.699703 -1.546459 -1.217717
C -0.565944 0.248546 0.441557
C -5.865270 0.473917 1.261688
C -5.475112 1.164588 -1.146930
C 4.140463 2.164558 0.190576
H -5.293494 -0.846364 -0.349741
H 4.671068 0.062155 -1.813632
H 1.179935 -2.408345 -1.823438
H 1.416821 0.771772 1.110766
H 2.370136 1.779064 -1.015523
H 3.798557 2.241795 -1.965057
H -1.280513 -2.197655 -1.865381
H -1.052289 0.995082 1.081589
H -3.203554 -1.183694 -1.082840
H -5.636843 -0.264160 2.040057
H -6.946587 0.449653 1.085571
H -5.620623 1.463160 1.678861
H -6.543631 1.080971 -1.382453
H -4.917911 0.971977 -2.070447
H -5.292763 2.211524 -0.863835
H 4.144543 3.271969 0.194005
H 5.170789 1.793948 0.320305
H 3.630789 0.932273 1.698750


%chk=000293142-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293142

0 1
S 3.231941 -1.074831 -0.116315
O 3.744414 -0.682476 1.401342
O 3.612500 -2.539956 -0.700887
O -3.296732 1.360068 0.961599
O 3.696669 2.042485 1.239123
N 3.845899 0.103554 -1.418879
N -2.798392 -0.445102 -0.455720
C 1.379653 -0.820788 -0.209040
C -5.159216 0.267076 -0.207296
C -1.387928 -0.534170 -0.339109
C 0.661677 -1.693889 -1.044177
C 0.773426 0.180906 0.567700
C -3.678360 0.455842 0.164466
C 3.633516 1.563044 -1.224090
C -0.734282 -1.544310 -1.102560
C -0.627630 0.328675 0.500659
C -5.980786 -0.004887 1.078305
C -5.666136 1.540662 -0.933461
C 4.350094 2.266799 -0.043699
H -5.267788 -0.600302 -0.891677
H 4.836155 -0.167753 -1.570184
H 1.182403 -2.471998 -1.610845
H 1.371112 0.836745 1.210352
H 2.546686 1.744812 -1.142359
H 3.965139 2.012565 -2.182653
H -1.320598 -2.214736 -1.742643
H -1.138919 1.095631 1.084379
H -3.233514 -1.128857 -1.079945
H -5.659734 -0.935199 1.580732
H -7.053771 -0.095845 0.832052
H -5.851666 0.830612 1.787912
H -6.739499 1.439464 -1.174338
H -5.115872 1.724345 -1.874216
H -5.533896 2.420733 -0.280378
H 4.298141 3.357460 -0.210911
H 5.422772 1.970626 -0.019577
H 3.831225 1.083195 1.517937


