%chk=000013773.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013773

0 1
 O   -1.457600      5.4099999E-02  -1.587900    
 N   -3.720200     -0.9699000     -0.3686000    
 C   -4.887400      -1.756600      2.8999999E-02
 C   -3.669200      0.1407000      0.5818000    
 C   -5.928600     -0.6907000      0.3371000    
 C   -5.128100      0.5572000      0.6969000    
 C   -2.495100      -1.755600     -0.3711000    
 C    1.178000     -0.3218000     -0.6158000    
 C   1.7400000E-02  -1.248900     -0.1836000    
 C   -1.332400     -0.8755000     -0.7920000    
 C   0.9828000       1.136800     -0.2156000    
 C    2.541300     -0.8378000     -0.1665000    
 C    1.534200       2.121800      -1.006800    
 C    3.648100     -0.5428000     -0.9330000    
 C   0.2611000       1.421900      0.9237000    
 C    2.620800      -1.581500      0.9913000    
 C    1.355600       3.455900     -0.6410000    
 C    4.894800      -1.014300     -0.5221000    
 C   8.2400002E-02   2.756200       1.289300    
 C    3.867700      -2.052900       1.402300    
 C   0.6298000       3.773000      0.5069000    
 C    5.004500      -1.769300      0.6455000    
 H   -4.689400      -2.351500      0.9299000    
 H   -5.222300      -2.429500     -0.7665000    
 H   -3.058300      0.9810000      0.2387000    
 H   -3.299400     -0.1806000       1.564300    
 H   -6.588400     -0.9987000       1.154500    
 H   -6.552800     -0.4901000     -0.5416000    
 H   -5.360600       1.362600     -9.8000001E-03
 H   -5.365500      0.9148000       1.704000    
 H   -2.558300      -2.578500      -1.091600    
 H   -2.291500      -2.178600      0.6197000    
 H    1.170700     -0.3563000      -1.716900    
 H   0.2310000      -2.271400     -0.5236000    
 H  -0.1230000      -1.293700      0.9005000    
 H    2.089000       1.891700      -1.910500    
 H    3.577100      3.1300001E-02  -1.851000    
 H  -0.1611000      0.6661000       1.574200    
 H    1.769300      -1.806900       1.621500    
 H    1.779100       4.248000      -1.251700    
 H    5.779800     -0.7961000      -1.112800    
 H  -0.4786000       3.003600       2.185800    
 H    3.954700      -2.636700       2.314100    
 H   0.4910000       4.811800      0.7920000    
 H    5.975300      -2.135900      0.9659000    


%chk=000013773-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013773

0 1
O -1.408296 -0.444273 -1.701952
N -3.791711 -0.974529 -0.175076
C -4.903552 -1.410454 0.709930
C -4.170222 0.389050 -0.635876
C -6.175520 -0.927675 -0.035178
C -5.684121 0.255657 -0.938685
C -2.466472 -1.110670 0.416424
C 1.231028 -0.349070 -0.456946
C 0.085347 -1.274449 0.042829
C -1.285999 -0.893574 -0.533432
C 1.093439 1.051141 0.170243
C 2.627836 -0.942825 -0.236479
C 0.429952 2.087127 -0.536129
C 3.713216 -0.433447 -0.997627
C 1.588264 1.323773 1.472055
C 2.896288 -1.959562 0.714664
C 0.261310 3.364656 0.045698
C 5.023306 -0.925455 -0.820176
C 1.418403 2.598592 2.056147
C 4.208421 -2.456194 0.897573
C 0.753173 3.625026 1.345118
C 5.277509 -1.941789 0.131692
H -4.842679 -0.924559 1.718964
H -4.877663 -2.505392 0.858828
H -3.567670 0.674692 -1.511142
H -3.998946 1.147595 0.172415
H -6.960970 -0.617304 0.675865
H -6.587914 -1.739025 -0.658506
H -5.838556 0.011736 -2.003234
H -6.220263 1.197312 -0.727368
H -2.358068 -2.127016 0.848588
H -2.289229 -0.402082 1.278065
H 1.073292 -0.237266 -1.547527
H 0.284630 -2.315613 -0.289880
H 0.033579 -1.291751 1.147966
H 0.040430 1.885031 -1.540770
H 3.523879 0.358708 -1.732632
H 2.129612 0.542862 2.019441
H 2.083295 -2.376694 1.319217
H -0.250844 4.154409 -0.515890
H 5.844477 -0.520478 -1.422481
H 1.811934 2.795036 3.060248
H 4.393520 -3.243995 1.636945
H 0.626445 4.616018 1.795616
H 6.293811 -2.326881 0.271357


