T1LD3
     RDKit          2D

 76 82  0  0  1  0  0  0  0  0999 V2000
  -17.0257   -4.9565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1522   -7.0397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -19.3692   -3.6753    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.2797    1.4605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0955   -0.6620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5293    3.3804    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8459   -2.5819    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5963   -4.5018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.7048   -3.4912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.1669   -4.0472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1416   -5.9313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.3838   -2.0260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.0749   -4.4334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9544   -1.5713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3480   -6.3245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.4923   -1.0154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.6334   -0.1061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5653   -5.4212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.3958   -5.8987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.7419    0.9045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.1713    0.4499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.2040    0.3486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4209    2.3698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8862   -6.8865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8830    1.8139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.7943   -7.2727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9914    2.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0072   -7.8833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.4999   -8.0308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4535    2.2685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6705    4.2897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1326    3.7338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2410    4.7444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9201    6.2096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4906    6.6643    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3822    5.6537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1697    8.1296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7031    4.1884    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9527    6.1084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8443    5.0978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4148    5.5524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3064    4.5418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8769    4.9965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7685    3.9859    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3390    4.4405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7694    3.4299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1989    3.8846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3073    2.8740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7368    3.3287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8452    2.3181    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.7727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3831    1.7621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8126    2.2168    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9210    1.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3505    1.6609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4589    0.6503    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8884    1.1049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9968    0.0943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4263    0.5490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.5347   -0.4616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9642   -0.0070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0726   -1.0176    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.5021   -0.5629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.6105   -1.5735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0400   -1.1188    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.1484   -2.1294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.5779   -1.6748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.8275   -3.5947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.6863   -2.6854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.1158   -2.2307    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   30.5881   -0.8070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.0881   -0.8163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.5428   -2.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.3238   -3.1199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.7140    0.4120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   31.3145   -4.6199    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0
  1  9  1  0
  2 11  1  0
  3 13  1  0
  4 21  1  0
  5 22  2  0
  6 23  2  0
  7 10  1  0
  7 14  1  0
  8  9  1  0
  8 10  1  0
  8 11  1  0
  9 12  1  0
  9 13  1  0
 10 18  1  0
 11 15  1  0
 12 14  2  0
 12 16  1  0
 13 19  1  0
 14 17  1  0
 16 21  2  0
 17 20  2  0
 17 22  1  0
 18 24  3  0
 19 26  3  0
 20 21  1  0
 20 23  1  0
 22 25  1  0
 23 27  1  0
 24 28  1  0
 25 27  2  0
 25 30  1  0
 26 29  1  0
 27 31  1  0
 28 29  2  0
 30 32  2  0
 31 33  2  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
 35 37  1  0
 36 38  2  0
 36 39  1  0
 39 40  1  0
 40 41  1  0
 41 42  1  0
 42 43  1  0
 43 44  1  0
 44 45  1  0
 45 46  1  0
 46 47  1  0
 47 48  1  0
 48 49  1  0
 49 50  1  0
 50 51  1  0
 51 52  1  0
 52 53  1  0
 53 54  1  0
 54 55  1  0
 55 56  1  0
 56 57  1  0
 57 58  1  0
 58 59  1  0
 59 60  1  0
 60 61  1  0
 61 62  1  0
 62 63  1  0
 63 64  1  0
 64 65  1  0
 65 66  1  0
 66 67  1  0
 66 68  2  0
 67 69  1  0
 69 70  1  0
 70 74  1  0
 70 71  1  0
 71 72  1  0
 71 75  2  0
 72 73  2  0
 73 74  1  0
 74 76  2  0
M  END
>  <s_m_entry_id>  (1) 
111

>  <s_m_entry_name>  (1) 
entry

>  <r_f3d_energy>  (1) 
0

>  <i_f3d_flags>  (1) 
0

$$$$
