
     RDKit          3D

 74 75  0  0  0  0  0  0  0  0999 V2000
   -4.8428    3.6765    0.2708 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3772    3.8358   -0.1510 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1449    3.2637   -1.5572 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3754    3.2810    0.8939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4523    1.7580    1.1746 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2074    1.3275    1.8233 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0018    1.0469    1.0994 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0888    1.5256    1.5225 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0300    0.1303   -0.1007 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6591   -1.2434    0.2105 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1382   -1.1199    0.4853 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5747   -1.1942    1.6675 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0449   -0.8740   -0.5977 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4701   -0.6478   -0.3612 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2007   -0.3400   -1.6748 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7123   -0.1544   -1.4661 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0074    0.9081   -0.4781 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8735    2.2487   -1.0776 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3721    0.7417    0.0484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0309   -1.8904    1.3377 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9216   -3.0115    1.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4223   -3.5245    2.2445 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2470   -3.5963   -0.1005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4444   -4.6618   -0.5390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6411   -5.2293   -1.7975 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6371   -4.7352   -2.6361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4469   -3.6799   -2.2134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2814   -3.1034   -0.9464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1693   -2.0614   -0.6199 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4075   -1.4987    0.6670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5158   -0.4532    0.5600 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5821    0.3647    1.7824 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6803    0.1386    2.7301 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6209    1.4095    2.0837 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7308    2.0439    3.1693 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9877    4.0343    1.3124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4923    4.2832   -0.3954 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1695    2.6191    0.1966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1815    4.9296   -0.2159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0700    3.3275   -1.8300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7252    3.8503   -2.3012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4735    2.2062   -1.6256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4876    3.8474    1.8441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3529    3.5198    0.5262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5484    1.2474    0.2092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0859    1.5881    2.8285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9841   -0.0427   -0.5041 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6021    0.6275   -0.9138 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5594   -1.8664   -0.7037 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6628   -0.8265   -1.5702 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9098   -1.5558    0.1059 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5867    0.2082    0.3389 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7611    0.5633   -2.1469 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0476   -1.1871   -2.3786 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1152   -1.1325   -1.1172 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1989    0.0617   -2.4441 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8275    2.4289   -1.4002 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5530    2.3733   -1.9504 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1101    3.0316   -0.3249 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6004    1.5360    0.7915 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4615   -0.2302    0.5799 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1269    0.7808   -0.7693 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0809   -1.4791    2.2926 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3490   -5.0455    0.0916 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0145   -6.0484   -2.1264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7845   -5.1718   -3.6157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2221   -3.3123   -2.8740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7209   -2.2940    1.3772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4935   -1.0089    1.0419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3726    0.1948   -0.3283 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4767   -0.9833    0.3832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3027    1.0559    2.8082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3349   -0.7008    2.4155 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2665   -0.1108    3.7304 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 17 19  1  0
 10 20  1  0
 20 21  1  0
 21 22  2  0
 21 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  2  0
 34  5  1  0
 28 23  1  0
  1 36  1  0
  1 37  1  0
  1 38  1  0
  2 39  1  0
  3 40  1  0
  3 41  1  0
  3 42  1  0
  4 43  1  0
  4 44  1  0
  5 45  1  0
  6 46  1  0
  9 47  1  0
  9 48  1  0
 10 49  1  0
 13 50  1  0
 14 51  1  0
 14 52  1  0
 15 53  1  0
 15 54  1  0
 16 55  1  0
 16 56  1  0
 18 57  1  0
 18 58  1  0
 18 59  1  0
 19 60  1  0
 19 61  1  0
 19 62  1  0
 20 63  1  0
 24 64  1  0
 25 65  1  0
 26 66  1  0
 27 67  1  0
 30 68  1  0
 30 69  1  0
 31 70  1  0
 31 71  1  0
 33 72  1  0
 33 73  1  0
 33 74  1  0
M  END
$$$$
