ATOMS
1  O        -5.994488    1.471391    1.550396    R=1.72
2  C        -6.474398    0.228201    1.770336    R=2.00
3  C        -7.837009   -0.034199    1.527184    R=2.00
4  C        -8.298025   -1.333707    1.745522    R=2.00
5  C        -7.457897   -2.367076    2.189529    R=2.00
6  C        -6.110345   -2.069482    2.412253    R=2.00
7  C        -5.605250   -0.779765    2.214807    R=2.00
8  H        -1.645303   -0.653172    2.177155    R=1.30
9  H        -9.352516   -1.550044    1.555362    R=1.30
10 H        -5.430794   -2.855949    2.749217    R=1.30
11 H        -4.532908   -0.992375    0.089532    R=1.30
12 Ta       -4.383726    2.396481    0.991103    R=2.025
13 H        -2.076688    0.954996    2.803821    R=1.30
14 O        -2.474699    2.853900    0.674264    R=1.72
15 N        -3.417257    0.207778    1.380356    R=1.83
16 O        -4.469064    1.691847   -0.851546    R=1.72
17 C        -1.307648    2.222277    0.367920    R=2.00
18 C        -1.029955    0.967282    0.931838    R=2.00
19 C         0.164433    0.324592    0.605400    R=2.00
20 C         1.089292    0.902818   -0.271250    R=2.00
21 C         0.782507    2.156126   -0.813761    R=2.00
22 C        -0.403392    2.835465   -0.514664    R=2.00
23 C        -2.005728    0.348219    1.888551    R=2.00
24 H         0.367859   -0.659260    1.035701    R=1.30
25 H         1.487347    2.623089   -1.506618    R=1.30
26 C        -3.569269    1.025101   -1.615693    R=2.00
27 C        -3.214921    1.525333   -2.882156    R=2.00
28 C        -2.236663    0.838764   -3.606671    R=2.00
29 C        -1.613217   -0.317314   -3.118291    R=2.00
30 C        -2.018424   -0.806276   -1.872660    R=2.00
31 C        -2.989267   -0.151657   -1.113399    R=2.00
32 H        -1.939275    1.232704   -4.582138    R=1.30
33 H        -1.550731   -1.706715   -1.467298    R=1.30
34 C        -3.473394   -0.714041    0.193067    R=2.00
35 H        -2.914712   -1.632594    0.439232    R=1.30
36 C        -4.172841   -0.447742    2.513586    R=2.00
37 H        -3.638721   -1.369329    2.798137    R=1.30
38 H        -4.110576    0.253322    3.358582    R=1.30
39 H        -4.956354    2.641278   -3.505311    R=1.30
40 H        -3.718530    3.619648   -2.723716    R=1.30
41 O        -5.174130    4.057508    0.520848    R=1.72
42 H        -8.750769    1.907153    1.748083    R=1.30
43 H        -7.194531   -4.483674    2.551300    R=1.30
44 H         2.132958   -0.663098   -1.333605    R=1.30
45 H         0.095194    4.540114   -1.733129    R=1.30
46 H        -3.461779    3.042987   -4.390704    R=1.30
47 H        -0.605832   -0.837123   -4.965102    R=1.30
48 C        -8.733249    1.067484    1.037729    R=2.00
49 H        -8.369641    1.475755    0.082944    R=1.30
50 H        -9.758808    0.705747    0.896484    R=1.30
51 C        -8.003023   -3.751673    2.427630    R=2.00
52 H        -8.622747   -3.781104    3.337343    R=1.30
53 H        -8.639623   -4.078976    1.593320    R=1.30
54 C        -0.739943    4.162746   -1.130581    R=2.00
55 H        -1.623353    4.073698   -1.780232    R=1.30
56 H        -0.989972    4.910405   -0.364071    R=1.30
57 C         2.352261    0.173539   -0.651468    R=2.00
58 H         3.060935    0.839548   -1.160599    R=1.30
59 H         2.852861   -0.252053    0.229901    R=1.30
60 C        -0.494158   -0.976660   -3.881363    R=2.00
61 H         0.477144   -0.542879   -3.592966    R=1.30
62 H        -0.444416   -2.054205   -3.673961    R=1.30
63 C        -3.868035    2.772077   -3.408581    R=2.00
64 C        -5.789715    4.709795   -0.575314    R=2.00
65 H        -5.189586    5.583976   -0.868526    R=1.30
66 H        -6.793512    5.050606   -0.282438    R=1.30
67 H        -5.873881    4.025412   -1.433378    R=1.30
68 H        -2.236338    3.474514    2.489041    R=1.30
69 O        -2.695123    3.332464    3.353807    R=1.72
70 O        -3.966627    2.792598    2.894973    R=1.72
END

SOLVATION
    Surf Esurf
    Solvent name=Chloroform cav0=0.0 cav1=0.0067639
    Charged method=CONJ
    C-Mat POT
    SCF VAR ALL 
    CSMRSP
END

BASIS
type TZ2P
core Small
createoutput None
END

XC
GGA PBE
DISPERSION Grimme3
END

RELATIVISTIC Scalar ZORA

AnalyticalFreq
END

ScanFreq -1000 0

NumericalQuality Good

NOPRINT LOGFILE

