%chk=000256187.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256187

0 1
P 0.011423 0.841952 -0.737633
P -0.054380 -0.842118 0.737316
O 0.015766 0.301509 -2.162663
O -0.058717 -0.301621 2.162355
C -1.449352 1.873488 -0.293192
C 1.513923 1.792500 -0.253467
C -1.556899 -1.792638 0.253202
C 1.406408 -1.873664 0.292973
C -1.743157 2.199658 1.032324
C 1.789529 2.103106 1.079675
C -1.832514 -2.103223 -1.079928
C 2.214084 -2.312283 1.341808
C -2.256982 2.312233 -1.342025
C 2.372106 2.185668 -1.279988
C -2.415126 -2.185758 1.279724
C 1.700199 -2.199895 -1.032540
C -2.861282 2.989728 1.307443
C 2.941401 2.831077 1.385194
C -2.984462 -2.831096 -1.385464
C 3.333062 -3.104115 1.064286
C -3.375910 3.104114 -1.064481
C 3.524818 2.915414 -0.972019
C -3.567875 -2.915401 0.971747
C 2.818373 -2.989890 -1.307632
C -3.681925 3.448201 0.261315
C 3.813585 3.243235 0.361738
C -3.856675 -3.243180 -0.362032
C 3.639067 -3.448256 -0.261484
C -4.874471 4.292443 0.572917
C 5.041658 4.021363 0.705766
C -5.084849 -4.021152 -0.706028
C 4.831504 -4.292645 -0.573093
H -1.130871 1.845168 1.873236
H 1.136467 1.783250 1.903626
H -1.179437 -1.783460 -1.903893
H 1.993397 -2.045503 2.382097
H -2.036295 2.045496 -2.382322
H 2.165106 1.930638 -2.326018
H -2.208067 -1.930742 2.325748
H 1.087860 -1.845509 -1.873442
H -3.099717 3.247243 2.337139
H 3.165922 3.075940 2.421085
H -3.208978 -3.075906 -2.421370
H 3.965042 -3.449577 1.878785
H -4.007856 3.449681 -1.878961
H 4.196269 3.225318 -1.769051
H -4.239368 -3.225286 1.768752
H 3.056840 -3.247439 -2.337311
H -5.409041 4.625584 -0.326017
H -5.597740 3.742465 1.193026
H -4.590086 5.195623 1.132066
H 4.791766 4.940559 1.255240
H 5.715713 3.434355 1.346984
H 5.618971 4.321778 -0.178144
H -5.661793 -4.322115 0.177936
H -5.759176 -3.433759 -1.346616
H -4.835179 -4.940005 -1.256169
H 4.546102 -5.198343 -1.127680
H 5.552547 -3.744743 -1.197573
H 5.368974 -4.621665 0.325629


%chk=000256187-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256187

0 1
P 0.009895 0.916620 -0.796189
P -0.053312 -0.916711 0.795944
O 0.017219 0.468971 -2.361843
O -0.060887 -0.469056 2.361594
C -1.495431 1.910839 -0.341670
C 1.553369 1.831878 -0.303562
C -1.596594 -1.832182 0.303119
C 1.452222 -1.910711 0.341629
C -1.850306 2.168729 1.004878
C 1.884058 2.073913 1.052115
C -1.927073 -2.074262 -1.052601
C 2.252352 -2.395150 1.400612
C -2.295592 2.395476 -1.400542
C 2.409610 2.266957 -1.339839
C -2.452905 -2.267390 1.339285
C 1.807328 -2.168551 -1.004869
C -3.000810 2.936947 1.278150
C 3.069172 2.774463 1.357245
C -3.112044 -2.774988 -1.357884
C 3.399302 -3.165732 1.109088
C -3.442326 3.166314 -1.108856
C 3.590849 2.970271 -1.016417
C -3.633999 -2.970875 1.015710
C 2.958045 -2.936504 -1.277979
C -3.809677 3.453651 0.230473
C 3.936971 3.238692 0.332465
C -3.979910 -3.239341 -0.333218
C 3.766873 -3.453039 -0.230185
C -5.044038 4.280082 0.544977
C 5.209657 3.989835 0.681392
C -5.252469 -3.990621 -0.682313
C 5.001253 -4.279509 -0.544516
H -1.263879 1.747554 1.830327
H 1.250591 1.691078 1.861180
H -1.293550 -1.691342 -1.861584
H 1.975045 -2.158678 2.434182
H -2.018438 2.159012 -2.434155
H 2.148593 2.045025 -2.380834
H -2.192052 -2.045428 2.380316
H 1.220949 -1.747470 -1.830401
H -3.279933 3.132807 2.320574
H 3.329329 2.956870 2.406995
H -3.372032 -2.957442 -2.407668
H 4.017266 -3.546668 1.930830
H -4.060279 3.547457 -1.930511
H 4.253130 3.312187 -1.820616
H -4.296329 -3.312899 1.819823
H 3.237387 -3.132261 -2.320363
H -5.538429 4.636748 -0.374611
H -5.783671 3.690743 1.119195
H -4.788949 5.164859 1.157673
H 4.990833 4.893330 1.280713
H 5.892855 3.360399 1.282349
H 5.753980 4.308204 -0.223925
H -5.796506 -4.309679 0.222935
H -5.935974 -3.360992 -1.282723
H -5.033549 -4.893686 -1.282240
H 4.745389 -5.167010 -1.152976
H 5.738850 -3.691843 -1.123013
H 5.498269 -4.632091 0.375230


