%chk=000197979.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197979

1 1
O 1.177828 -2.305550 0.000404
N -1.267559 -0.897934 0.000256
C -0.016621 -0.247271 0.000178
C 0.020677 1.184280 0.000143
C 1.246874 -0.941106 0.000218
C -1.219561 1.909825 0.000073
C -2.414768 -0.191570 0.000070
C 1.265250 1.861247 0.000151
C -2.408178 1.232062 -0.000021
C -1.337129 -2.375942 0.000472
C 2.449216 -0.254446 0.000131
C 2.454352 1.157163 0.000139
H -1.189976 3.008316 0.000206
H -3.382976 -0.726371 0.000088
H 1.274967 2.956331 0.000306
H -3.373516 1.756399 -0.000160
H -0.820004 -2.800547 0.891469
H -2.374889 -2.756973 0.000753
H -0.820428 -2.800794 -0.890653
H 3.401539 -0.792445 0.000079
H 3.415865 1.685850 0.000148
H 2.086636 -2.734025 0.000149


%chk=000197979-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197979

1 1
O 1.265382 -2.357743 0.000310
N -1.254093 -0.913713 0.000296
C 0.005620 -0.269235 0.000294
C 0.027165 1.185168 0.000203
C 1.266075 -0.964503 0.000288
C -1.208754 1.905338 0.000105
C -2.408719 -0.189528 0.000159
C 1.268468 1.892148 0.000164
C -2.423737 1.221019 0.000052
C -1.394439 -2.406336 0.000431
C 2.465241 -0.231238 0.000207
C 2.473154 1.188794 0.000157
H -1.182366 2.999470 0.000043
H -3.338455 -0.761574 0.000147
H 1.255470 2.985886 0.000106
H -3.385326 1.736937 -0.000080
H -0.913650 -2.831724 0.891619
H -2.466693 -2.648301 0.000587
H -0.913878 -2.831855 -0.890830
H 3.419158 -0.773011 0.000154
H 3.428968 1.719356 0.000080
H 2.183009 -2.728855 0.000107


