%chk=000183768.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183768

0 1
O 1.304363 2.089620 -0.370772
O -3.216563 2.351841 -0.464538
O -2.644146 -0.867957 -1.914667
O -4.335932 -2.472846 -0.413231
N 2.672943 -0.123377 -0.088829
C -0.327010 0.403813 -0.854014
C 0.559217 1.032924 0.266689
C 1.344301 -0.315378 0.548264
C 0.704414 -0.147664 -1.915548
C -0.268090 1.717734 1.376204
C -1.224318 1.486973 -1.459242
C -1.135693 -0.691378 -0.084996
C 2.242851 0.009607 -1.567603
C 0.700152 -0.925556 1.783991
C 3.599075 -1.271946 0.158142
C 4.995653 -0.893743 -0.306436
C -0.711508 -1.206054 1.205522
C -1.204556 2.767086 0.762411
C -2.016077 2.202994 -0.388150
C 6.041806 -0.443942 0.701614
C 6.160185 -1.806927 0.048082
C -2.335587 -1.179103 -0.606381
C -1.535590 -2.044242 1.939416
C 2.318278 2.745489 0.420938
C -3.157799 -2.058914 0.167663
C -2.778567 -2.466516 1.437344
C -4.003370 -0.399755 -2.160636
H 0.999656 -1.214824 -0.128485
H 0.547582 0.373189 -2.876174
H 0.475784 -1.209802 -2.112207
H 0.412224 2.199560 2.104008
H -0.878189 1.008901 1.965715
H -1.891942 1.066048 -2.238872
H -0.580071 2.233809 -1.977728
H 2.805947 -0.696159 -2.202597
H 2.548520 1.045601 -1.836552
H 0.675596 -0.278422 2.673851
H 1.183872 -1.864497 2.104854
H 3.599469 -1.482504 1.251140
H 3.286833 -2.214468 -0.344234
H 5.003949 -0.407255 -1.290204
H -0.605473 3.621145 0.376367
H -1.878675 3.182181 1.536540
H 5.780588 -0.373542 1.754380
H 6.737981 0.345545 0.430378
H 6.942061 -1.984572 -0.685742
H 5.988118 -2.700752 0.641423
H -1.222067 -2.400492 2.920633
H 3.026018 2.017261 0.834571
H 1.852276 3.344109 1.206923
H 2.811940 3.381557 -0.321746
H -3.412607 -3.117104 2.032581
H -4.851386 -3.058318 0.197417
H -4.721530 -1.207383 -1.982474
H -3.958024 -0.137836 -3.222718
H -4.209985 0.480040 -1.536281


%chk=000183768-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183768

0 1
O 1.312771 2.161706 -0.387288
O -3.326950 2.419817 -0.338419
O -2.649409 -0.910521 -1.944143
O -4.258047 -2.696867 -0.501264
N 2.692773 -0.115476 -0.069030
C -0.356512 0.481319 -0.830901
C 0.540695 1.086260 0.270698
C 1.344764 -0.254096 0.541656
C 0.706149 -0.035858 -1.931266
C -0.262542 1.755481 1.417682
C -1.287129 1.590309 -1.410462
C -1.136142 -0.677021 -0.057197
C 2.283906 0.010036 -1.569576
C 0.749438 -0.900075 1.795275
C 3.554163 -1.304451 0.183956
C 4.966481 -1.132671 -0.357270
C -0.691551 -1.192043 1.239586
C -1.222912 2.836796 0.841488
C -2.070973 2.287738 -0.306073
C 6.014500 -0.375156 0.465298
C 6.123040 -1.902009 0.298697
C -2.332616 -1.219129 -0.610535
C -1.502705 -2.097453 1.947491
C 2.355442 2.814488 0.413302
C -3.114094 -2.162657 0.127409
C -2.721543 -2.566903 1.414998
C -4.019801 -0.413267 -2.251841
H 0.920665 -1.010582 -0.148854
H 0.598777 0.602373 -2.827354
H 0.417363 -1.056786 -2.240453
H 0.424148 2.224734 2.146305
H -0.865953 1.024544 1.975782
H -1.959039 1.207850 -2.187249
H -0.605011 2.343598 -1.852849
H 2.759193 -0.829417 -2.121561
H 2.694498 0.957497 -1.945106
H 0.742693 -0.275399 2.706922
H 1.222936 -1.867988 2.047547
H 3.608978 -1.447199 1.281355
H 3.104618 -2.239152 -0.246018
H 5.027938 -1.008360 -1.445093
H -0.616831 3.669767 0.432545
H -1.889224 3.235730 1.625573
H 5.703787 0.014531 1.439846
H 6.736010 0.256461 -0.060823
H 6.915976 -2.301839 -0.339727
H 5.892039 -2.527370 1.167830
H -1.161044 -2.471505 2.919138
H 3.071529 2.061401 0.787360
H 1.927486 3.409840 1.246310
H 2.864272 3.500203 -0.284559
H -3.332405 -3.286154 1.976321
H -4.693763 -3.358303 0.091421
H -4.769448 -1.186150 -2.025358
H -3.995765 -0.200954 -3.332121
H -4.218723 0.514132 -1.683395


