%chk=000261254.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261254

0 1
S 1.394039 2.077454 0.927421
P -0.172275 1.741057 -0.399728
O -1.060348 0.798096 0.649004
O -0.897095 2.834279 -1.065682
O 5.511617 -0.866981 0.822113
N 0.646137 0.610905 -1.439225
C 1.887728 0.154683 -0.942001
C 2.379797 0.786434 0.230150
C -2.285437 0.272540 0.252991
C 2.642584 -0.858875 -1.549059
C 3.586258 0.425759 0.797421
C 4.327836 -0.598673 0.165391
C -3.745735 -1.629911 0.443874
C -4.455416 0.360797 -0.771606
C -3.227485 0.984397 -0.490724
C -2.514388 -1.027345 0.726003
C 3.869579 -1.236713 -0.993492
C -4.709687 -0.937329 -0.309208
C -4.043358 -3.006578 0.942261
C -5.489772 1.102555 -1.553427
C 6.363490 -1.901609 0.276013
H 0.295995 0.253938 -2.331716
H 2.280277 -1.353142 -2.447958
H 3.978477 0.896228 1.699560
H -3.042966 2.005597 -0.832950
H -1.746861 -1.528763 1.308558
H 4.449491 -2.022384 -1.470286
H -5.662190 -1.412062 -0.526576
H -3.161746 -3.505511 1.365811
H -4.807736 -2.977447 1.733514
H -4.429232 -3.653588 0.142306
H -5.988488 1.852766 -0.920110
H -5.049554 1.646362 -2.401930
H -6.271441 0.447171 -1.957380
H 6.698352 -1.629651 -0.728924
H 5.849877 -2.866961 0.291480
H 7.203178 -1.893197 0.984314


%chk=000261254-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261254

0 1
S 1.562848 2.260668 1.087694
P -0.173137 1.914857 -0.357261
O -1.169083 0.957037 0.736970
O -0.951383 3.061746 -1.140318
O 5.620332 -0.994355 0.818820
N 0.739823 0.824340 -1.361117
C 1.962079 0.297539 -0.877179
C 2.499690 0.879204 0.309438
C -2.382894 0.328125 0.309063
C 2.666286 -0.750430 -1.504679
C 3.712161 0.426619 0.850852
C 4.416220 -0.618532 0.200694
C -3.789768 -1.658350 0.483048
C -4.527179 0.295931 -0.849051
C -3.330693 0.978386 -0.507478
C -2.592228 -0.976720 0.803082
C 3.896148 -1.205320 -0.978399
C -4.739286 -1.013251 -0.352623
C -4.058603 -3.047839 1.035684
C -5.571085 0.982359 -1.713879
C 6.386302 -2.074962 0.194792
H 0.407204 0.586375 -2.295768
H 2.257549 -1.216082 -2.408066
H 4.134094 0.856385 1.763521
H -3.143821 1.997068 -0.865159
H -1.823295 -1.436876 1.431899
H 4.425621 -2.014085 -1.488994
H -5.663825 -1.541828 -0.617591
H -3.122923 -3.561609 1.316392
H -4.691801 -2.995719 1.942574
H -4.590472 -3.678990 0.301493
H -6.129456 1.741167 -1.132596
H -5.107461 1.506754 -2.568765
H -6.305658 0.260587 -2.110724
H 6.699521 -1.805931 -0.833101
H 5.807268 -3.019022 0.171926
H 7.274407 -2.200949 0.831008


