%chk=000071874.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071874

0 1
 O    10.53100      0.3326000      0.1348000    
 N    6.929000     -0.4141000      4.9800001E-02
 C   -1.863100      0.4191000     -0.1285000    
 C  -0.6053000     -0.4511000     -0.1211000    
 C   -3.130800     -0.4350000     -7.2700001E-02
 C   0.6629000      0.4037000     -0.1436000    
 C   -4.388000      0.4361000     -4.6500001E-02
 C    1.921500     -0.4661000     -0.1023000    
 C   -5.657200     -0.4190000     -2.4400000E-02
 C    3.188100      0.3927000     -9.2699997E-02
 C   -6.912300      0.4545000      3.5399999E-02
 C    4.480400     -0.4283000     -3.9600000E-02
 C   -8.213400     -0.3515000      8.2800001E-02
 C    5.742200      0.4333000     -2.2000000E-03
 C   -9.468600      0.5212000      0.1172000    
 C   -10.73180     -0.3257000      0.1507000    
 C    8.140100      0.3921000      9.6400000E-02
 C    9.375200     -0.4945000      0.1065000    
 H   -1.876200       1.040000      -1.032600    
 H   -1.842600       1.100100      0.7311000    
 H  -0.6038000      -1.084800      0.7741000    
 H  -0.6144000      -1.119600     -0.9905000    
 H   -3.161800      -1.101000     -0.9436000    
 H   -3.108000      -1.071200      0.8204000    
 H   0.6605000       1.085000      0.7161000    
 H   0.6731000       1.024100      -1.047900    
 H   -4.402300       1.089500     -0.9273000    
 H   -4.365100       1.085000      0.8374000    
 H    1.903600      -1.099100      0.7931000    
 H    1.937700      -1.134600     -0.9714000    
 H   -5.636400      -1.087200      0.8450000    
 H   -5.692800      -1.052200     -0.9189000    
 H    3.159200       1.067900      0.7716000    
 H    3.203200       1.025900     -0.9884000    
 H   -6.932700       1.116200     -0.8395000    
 H   -6.862300       1.101400      0.9202000    
 H    4.454400      -1.074800      0.8472000    
 H    4.513700      -1.091900     -0.9133000    
 H   -8.199600      -1.001600      0.9665000    
 H   -8.256400      -1.010600     -0.7934000    
 H    5.705400       1.083300      0.8801000    
 H    5.769600       1.073600     -0.8922000    
 H   -9.492800       1.171300     -0.7648000    
 H   -9.444400       1.170900      0.9996000    
 H    6.951100      -1.024500     -0.7667000    
 H   -10.75140     -0.9662000       1.038300    
 H   -11.61770      0.3166000      0.1756000    
 H   -10.79990     -0.9641000     -0.7359000    
 H    8.194000       1.068500     -0.7663000    
 H    8.148800       1.026100      0.9918000    
 H    9.389000      -1.141200      0.9901000    
 H    9.420700      -1.119300     -0.7918000    
 H    11.30380     -0.2576000      0.1413000    


%chk=000071874-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071874

0 1
O 10.741353 0.156215 0.036512
N 7.057764 -0.389919 -0.086758
C -1.886046 0.474552 -0.015549
C -0.592693 -0.371316 -0.024396
C -3.174740 -0.378402 -0.003728
C 0.697599 0.479221 -0.034705
C -4.469697 0.465080 0.003699
C 1.988794 -0.369821 -0.044760
C -5.757042 -0.389942 0.016011
C 3.280267 0.478785 -0.053799
C -7.053181 0.451909 0.022620
C 4.566768 -0.376707 -0.064481
C -8.339857 -0.404176 0.034340
C 5.853630 0.470617 -0.063500
C -9.636723 0.437376 0.040765
C -10.916182 -0.427162 0.051808
C 8.343401 0.340691 -0.076189
C 9.505411 -0.642674 0.099354
H -1.894999 1.139448 -0.904685
H -1.880863 1.142648 0.871179
H -0.584908 -1.037163 0.864015
H -0.598193 -1.038670 -0.911761
H -3.178903 -1.047309 -0.889925
H -3.165750 -1.042734 0.885838
H 0.704073 1.145674 0.853207
H 0.690118 1.145645 -0.922709
H -4.479449 1.128988 -0.886181
H -4.465963 1.134247 0.889648
H 1.995682 -1.036862 0.842470
H 1.981747 -1.035545 -0.933357
H -5.747246 -1.053621 0.906060
H -5.760135 -1.059561 -0.869637
H 3.287570 1.141995 0.836432
H 3.272088 1.147720 -0.939817
H -7.063165 1.115800 -0.867342
H -7.050687 1.121278 0.908504
H 4.585379 -1.047997 0.816073
H 4.559416 -1.032520 -0.961912
H -8.331320 -1.068109 0.924287
H -8.343675 -1.073686 -0.851458
H 5.890324 1.082151 0.860210
H 5.819869 1.191044 -0.921437
H -9.644105 1.100693 -0.848339
H -9.632207 1.105573 0.926215
H 7.012397 -1.059628 -0.869138
H -10.946483 -1.077463 0.946576
H -11.828973 0.196868 0.056373
H -10.958645 -1.082248 -0.838961
H 8.526289 0.949026 -0.994962
H 8.339925 1.042095 0.778795
H 9.401682 -1.165477 1.071840
H 9.486320 -1.403462 -0.713614
H 11.521066 -0.429268 0.205268


