%chk=000175995.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175995

0 1
 O    2.388400      0.6264000      6.0000001E-03
 O   -2.385400      0.6168000      9.3999999E-03
 N    7.218000      0.9372000     -8.7000001E-03
 N   -7.223700      0.9288000      1.6600000E-02
 C    8.486300      0.2007000     -3.5999999E-03
 C   -8.487200      0.2055000     -9.6000005E-03
 C    6.093200      1.7300000E-02 -1.0100000E-02
 C   -6.095500      5.5999998E-03  1.4300000E-02
 C    8.569500     -0.6778000      -1.257400    
 C    8.539000     -0.6716000       1.255100    
 C    9.638000       1.211400      8.5000005E-03
 C   -9.632700       1.223200     -1.5000000E-02
 C   -8.585500     -0.6919000       1.229700    
 C   -8.535100     -0.6469000      -1.282200    
 C    4.777800      0.7894000     -1.9500000E-02
 C   -4.779800      0.7771000      3.1300001E-02
 C    3.578900     -0.1492000      1.1000000E-03
 C   -3.581300     -0.1617000      7.1000000E-03
 C    1.202400     -6.0899999E-02  6.3999998E-03
 C   -1.205100     -6.0899999E-02  7.1000000E-03
 C   1.4000000E-03  0.6389000      8.9999996E-03
 C    1.213600      -1.450900      1.9000000E-03
 C   -1.202300      -1.455800      2.4999999E-03
 C   7.1000000E-03  -2.150800       0.000000    
 H    7.169700       1.541400     -0.8290000    
 H   -7.175800       1.525300      0.8425000    
 H    6.074000     -0.6125000      0.8840000    
 H    6.083700     -0.6310000     -0.8913000    
 H   -6.075300     -0.6192000     -0.8832000    
 H   -6.090800     -0.6472000      0.8924000    
 H    8.339700     -0.1104000      -2.167200    
 H    9.588000      -1.068300      -1.377200    
 H    7.916600      -1.556000      -1.221600    
 H    7.895500      -1.556200       1.204100    
 H    8.279900     -0.1023000       2.155800    
 H    9.556500      -1.053900       1.406000    
 H    9.590100       1.860200      0.8910000    
 H    10.60970      0.7047000      2.4100000E-02
 H    9.615700       1.854000     -0.8796000    
 H   -9.574400       1.885200     -0.8871000    
 H   -9.614200       1.851900      0.8831000    
 H   -10.60720      0.7225000     -4.6000000E-02
 H   -7.935300      -1.571900       1.186500    
 H   -9.606400      -1.080400       1.333400    
 H   -8.362400     -0.1398000       2.150400    
 H   -9.554200      -1.018800      -1.447900    
 H   -8.263800     -6.6000000E-02  -2.172000    
 H   -7.899300      -1.537500      -1.239400    
 H    4.715500       1.434800     -0.9054000    
 H    4.722400       1.463300      0.8456000    
 H   -4.722600       1.456400     -0.8293000    
 H   -4.719200       1.416800      0.9214000    
 H    3.622700     -0.7779000     -0.8972000    
 H    3.635900     -0.7644000      0.9079000    
 H   -3.624000     -0.7962000      0.9013000    
 H   -3.633600     -0.7712000     -0.9037000    
 H   1.0000000E-03   1.725700      1.2100000E-02
 H    2.112900      -2.056400      1.3000000E-03
 H   -2.099600      -2.065000     -7.9999998E-04
 H   9.3000000E-03  -3.237200     -3.5000001E-03


%chk=000175995-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000175995

0 1
O 2.373696 -0.005096 0.020642
O -2.374378 -0.006258 -0.025612
N 7.160192 0.936120 -0.075598
N -7.161215 0.933087 0.071391
C 8.621810 0.609987 -0.032407
C -8.622743 0.606554 0.028247
C 6.178304 -0.164950 0.009163
C -6.178955 -0.167671 -0.013093
C 9.064726 -0.350957 -1.178567
C 8.966895 -0.018296 1.341159
C 9.366471 1.960173 -0.175755
C -9.367692 1.956611 0.171278
C -9.065492 -0.354210 1.174631
C -8.967710 -0.022106 -1.345187
C 4.747621 0.415053 0.008602
C -4.748481 0.412849 -0.012901
C 3.681777 -0.682418 0.033520
C -3.682179 -0.684146 -0.038892
C 1.220409 -0.807264 0.011013
C -1.220696 -0.807867 -0.016548
C -0.000321 -0.099145 -0.002576
C 1.233566 -2.228215 0.012938
C -1.233127 -2.228830 -0.019265
C 0.000392 -2.914552 -0.003359
H 6.954309 1.544392 -0.882419
H -6.955524 1.541657 0.878035
H 6.347605 -0.715728 0.954121
H 6.267014 -0.912931 -0.820025
H -6.348165 -0.718890 -0.957819
H -6.267281 -0.915332 0.816410
H 8.855895 0.098278 -2.168512
H 10.149176 -0.560582 -1.120767
H 8.532979 -1.318663 -1.120145
H 8.522583 -1.023688 1.459844
H 8.592097 0.626947 2.155012
H 10.061642 -0.125825 1.448121
H 9.076388 2.642497 0.642324
H 10.460772 1.811410 -0.146034
H 9.118082 2.450216 -1.137903
H -9.077934 2.638736 -0.647086
H -9.119246 2.447047 1.133215
H -10.461964 1.807581 0.141812
H -8.533454 -1.321772 1.116493
H -10.149875 -0.564164 1.116777
H -8.856888 0.095328 2.164487
H -10.062447 -0.129636 -1.452229
H -8.592810 0.622903 -2.159180
H -8.523418 -1.027543 -1.463528
H 4.592461 1.035421 -0.896593
H 4.622139 1.079078 0.881980
H -4.623753 1.077370 -0.886015
H -4.593123 1.032800 0.892542
H 3.768632 -1.343620 -0.854753
H 3.771044 -1.305836 0.948331
H -3.768627 -1.346142 0.848828
H -3.771294 -1.306814 -0.954227
H -0.000585 0.993726 -0.002264
H 2.170197 -2.791329 0.026668
H -2.169471 -2.792413 -0.033285
H 0.000672 -4.010528 -0.003643


