%nproc=4
%chk=rs_Ts_nobenzoicacid_NHCOCH3_b97d_1_scrfb97d.chk
%mem=14400MB
#p rb97d/6-31+g(d,p)  scrf=(solvent=cyclohexanone,smd)

Title Card Required

0 1
 C                  3.02864800    0.01465900    1.72663500
 C                  3.51295400    1.47921000    1.47761300
 C                  2.99510200    1.95806800    0.14720700
 C                  3.56634800    1.33856800   -0.98702200
 C                  2.53843100   -2.28900800    0.88424400
 C                  1.23121500    3.02758500   -1.24145000
 C                 -0.05874800    3.76472700   -0.84243700
 C                  0.27016200    4.35192400    0.54212000
 C                  1.10400800    3.23036800    1.20385100
 H                  1.47175600   -2.07947500    1.04832400
 H                  3.57481800   -0.36577900    2.60150400
 H                  1.95944500    0.01978000    1.96467900
 H                  3.18968000    2.10810800    2.31714300
 H                  4.60974300    1.47118200    1.44839700
 H                  4.61532300    1.06341700   -0.88529100
 H                  3.26991800    1.65954100   -1.98565800
 H                  1.78882600    3.63086200    1.96063900
 H                  0.89067600    5.25759100    0.44874100
 H                 -0.61952900    4.58746100    1.13925500
 H                 -0.33609400    4.53014300   -1.57960600
 H                 -0.88664000    3.05233200   -0.75669900
 H                  1.93106900    3.67293700   -1.79946300
 H                  1.04486900    2.11177800   -1.81330100
 C                  3.25965700   -0.94973000    0.54466800
 C                  4.75873200   -1.23325900    0.33776700
 C                  2.59067800   -0.41592900   -0.79555100
 C                  5.12087500   -2.06758600   -0.89076000
 C                  3.06798500   -1.14193500   -2.07657300
 C                  4.57905800   -1.39819800   -2.17851000
 H                  6.21278900   -2.18658300   -0.92120700
 H                  2.53794900   -2.11204000   -2.08161000
 H                  5.11742700   -0.45343200   -2.35347200
 O                  1.33228900   -0.16762500   -0.75157100
 O                  5.62487600   -0.79024100    1.08731400
 H                  4.66316400   -3.06725400   -0.79644600
 H                  4.79014900   -2.04910100   -3.04150900
 H                  2.69230900   -0.57755400   -2.94252500
 H                  2.63048700   -3.02160600    0.06953100
 C                  0.17045900    2.22191900    1.93174800
 O                 -0.31576300    2.54004900    3.01908300
 N                 -0.08780700    1.07991500    1.23933700
 C                 -3.66524700    3.29192600    0.51964100
 C                 -3.05430400    2.05001500    0.60568300
 C                 -2.72296800    1.30914400   -0.56914400
 C                 -3.07912400    1.87345800   -1.85162300
 C                 -3.71713600    3.14659000   -1.90260500
 C                 -3.99736500    3.85163700   -0.74321100
 H                 -3.89350300    3.84181800    1.43485800
 H                 -2.80195900    1.64365200    1.58345100
 C                 -2.03017100    0.04671600   -0.52909600
 C                 -2.76881100    1.15394600   -3.04253300
 H                 -3.97552400    3.55868200   -2.88144200
 H                 -4.47881500    4.83028600   -0.79683700
 C                 -2.08100600   -0.04122700   -2.98852200
 C                 -1.68149200   -0.57439100   -1.73103500
 H                 -3.06540800    1.57843200   -4.00465400
 H                 -1.82090600   -0.59113200   -3.89092700
 C                 -3.65679200   -4.26151600    1.95524400
 C                 -2.83994400   -3.58802700    2.84865000
 C                 -2.19539700   -2.37238600    2.47776400
 C                 -2.40396200   -1.83504400    1.15193000
 C                 -3.26342200   -2.54745700    0.26269500
 C                 -3.86585100   -3.73354800    0.65277700
 H                 -1.21667900   -2.08257100    4.39649000
 H                 -4.14087400   -5.19523000    2.24898300
 H                 -2.67193800   -3.97895200    3.85535500
 C                 -1.35144000   -1.67598700    3.39145700
 C                 -1.74039300   -0.61173900    0.78233800
 H                 -3.42927500   -2.16676900   -0.74342500
 H                 -4.50682300   -4.26582000   -0.05263200
 C                 -0.87365800   -0.00958100    1.69789100
 C                 -0.69525900   -0.52165000    3.01292800
 H                 -0.03961300    0.01324000    3.69764300
 N                 -0.84372900   -1.71563200   -1.68059300
 H                  0.46775900    0.84282400    0.39375300
 H                  0.02153600   -1.56357600   -1.15387000
 O                 -2.07443400   -3.11060100   -3.03262300
 N                  1.86502700    2.67078000    0.06225600
 H                  2.95857500   -2.73150900    1.80102800
 C                 -0.02015100   -3.97616800   -2.08114900
 H                  0.30241900   -4.39624300   -3.04520500
 H                  0.85603400   -3.60461600   -1.52756700
 H                 -0.48427700   -4.78922000   -1.50142400
 C                 -1.08150800   -2.90171000   -2.33356700




