
     RDKit          3D

 72 76  0  0  0  0  0  0  0  0999 V2000
   -2.9966   -3.5164    2.3346 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0990   -2.3313    1.9196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9524   -1.6917    1.3336 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0963   -0.4736    0.5317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7665    0.1897    0.0686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1310    1.4970   -0.7423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9998    1.3127   -2.0184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5253    1.3618   -1.7334 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3118    0.2927   -2.5211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7032    0.0109   -1.9061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8208   -1.4019   -1.3025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9571   -1.5857   -0.1717 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2350   -1.1972    1.1512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3814   -0.4405    1.4786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6416   -0.0837    2.8029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7831   -0.5004    3.8256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1224   -0.0697    5.4925 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -4.6447   -1.2465    3.5195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3507   -1.5833    2.1870 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0776    0.6169    1.3148 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6092    0.5822    1.1025 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9902    0.7049   -0.3175 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0934    1.5396   -0.7380 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1495    1.9277   -1.9387 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1422    2.0254    0.2372 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5127    2.2428   -0.4173 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1001    0.9661   -0.8293 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0708    0.4141   -2.0694 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6990   -0.7881   -2.1358 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.1237   -0.9789   -0.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8500   -2.0586   -0.3739 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1993   -2.0402    0.9900 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8179   -0.9558    1.8118 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0868    0.1218    1.2776 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7591    0.0692   -0.0781 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3506   -0.1603   -1.3253 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0684   -0.8091   -0.7859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0189   -2.1365    1.4817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6650   -0.7594   -0.3697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6770    0.2732    1.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1971    2.0252   -1.0408 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6532    2.2159   -0.0715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7060    0.3871   -2.5634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7649    2.1573   -2.7181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7369    1.2564   -0.6520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9126    2.3673   -2.0106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7341   -0.6479   -2.5975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4440    0.6613   -3.5574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9744    0.7726   -1.1450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4659    0.0928   -2.7099 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8757   -1.6124   -1.0187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5529   -2.1490   -2.0798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0807   -0.1111    0.7169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5223    0.5028    3.0390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9727   -1.5499    4.3181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1440   -0.0389    2.1863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2165    1.6388    1.6514 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0427    1.4024    1.7088 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0164   -0.3771    1.4916 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2688    1.2925    1.0609 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7999    2.9873    0.6739 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4301    2.9284   -1.2901 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1822    2.7443    0.3116 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6022    0.8838   -2.9252 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1302   -2.8850   -1.0167 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7572   -2.8659    1.4132 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0901   -0.9484    2.8581 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7978    0.9609    1.9004 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0940    0.4323   -2.2313 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0641   -0.9544   -1.6369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5209   -1.2315   -1.6252 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3783   -1.6774   -0.1662 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 16 18  1  0
 18 19  2  0
  5 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 32 33  2  0
 33 34  1  0
 34 35  2  0
 22 36  1  0
 36 37  1  0
 19  2  1  0
 35 27  1  0
 37  5  1  0
 19 13  1  0
 35 30  1  0
  3 38  1  0
  4 39  1  0
  4 40  1  0
  6 41  1  0
  6 42  1  0
  7 43  1  0
  7 44  1  0
  8 45  1  0
  8 46  1  0
  9 47  1  0
  9 48  1  0
 10 49  1  0
 10 50  1  0
 11 51  1  0
 11 52  1  0
 14 53  1  0
 15 54  1  0
 18 55  1  0
 20 56  1  0
 20 57  1  0
 21 58  1  0
 21 59  1  0
 25 60  1  0
 25 61  1  0
 26 62  1  0
 26 63  1  0
 28 64  1  0
 31 65  1  0
 32 66  1  0
 33 67  1  0
 34 68  1  0
 36 69  1  0
 36 70  1  0
 37 71  1  0
 37 72  1  0
M  END
$$$$
