
 OpenBabel04291915483D

 49 53  0  0  0  0  0  0  0  0999 V2000
   -3.3789    1.3469   17.1770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6651    1.2814   16.3696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3301    1.1656   14.8915 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6162    1.1001   14.0840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7140    1.4627   18.6551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3000    0.9909   12.6891 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2540    0.9203   11.8106 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9580    0.8180   10.5047 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6756    0.7887   10.1072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1020    0.9635   12.3177 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6150    0.8672   11.0839 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3326    0.8378   10.6864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3462    0.9108   11.5947 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0638    0.8815   11.1972 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2322    0.7792    9.8913 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9110    0.9694   12.3898 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9271    0.9548   12.1097 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2153    0.9253   11.7104 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2017    0.9983   12.6187 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4841    0.9690   12.2212 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4705    1.0420   13.1295 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7529    1.0126   12.7320 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5113    0.8230   10.4045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9444    0.7450    9.5964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1846    0.7734    9.9808 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4709    0.8723   11.2438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4942    0.9487   12.1951 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6366    0.6387    8.2384 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8097    2.2001   16.8724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8070    0.4582   17.0094 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2370    2.1701   16.5371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2344    0.4281   16.6741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7581    0.2770   14.7239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7608    2.0189   14.5869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6317    1.0722   13.7481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6625    2.3820   19.2001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6353    0.9755   19.6045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1051    0.7592    9.6828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5736    0.9894   12.5983 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8357    0.7144    9.0566 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5144    1.0342   13.2245 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9742    1.0769   13.6223 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7116    0.8904   11.2176 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2430    1.1206   14.1331 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7797    1.0224   12.8356 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0880    0.7486    9.4662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4606    0.8938   11.5355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6965    0.6172    7.9469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3597    0.5852    7.5724 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1 29  1  0  0  0  0
  1 30  1  0  0  0  0
  2  3  1  0  0  0  0
  2 31  1  0  0  0  0
  2 32  1  0  0  0  0
  3  4  1  0  0  0  0
  3 33  1  0  0  0  0
  3 34  1  0  0  0  0
  4  6  1  0  0  0  0
  4  5  1  0  0  0  0
  4 35  1  0  0  0  0
  5 36  1  0  0  0  0
  5 37  1  0  0  0  0
  6  7  1  0  0  0  0
  6 10  1  0  0  0  0
  7  8  2  0  0  0  0
  7 27  1  0  0  0  0
  8 24  1  0  0  0  0
  8  9  1  0  0  0  0
  9 11  1  0  0  0  0
  9 10  2  0  0  0  0
 11 12  2  0  0  0  0
 11 16  1  0  0  0  0
 12 13  1  0  0  0  0
 12 38  1  0  0  0  0
 13 14  2  0  0  0  0
 13 39  1  0  0  0  0
 14 17  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 40  1  0  0  0  0
 16 41  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 23  1  0  0  0  0
 19 20  1  0  0  0  0
 19 42  1  0  0  0  0
 20 21  2  0  0  0  0
 20 43  1  0  0  0  0
 21 22  1  0  0  0  0
 21 44  1  0  0  0  0
 22 23  2  0  0  0  0
 22 45  1  0  0  0  0
 23 46  1  0  0  0  0
 24 28  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 26 47  1  0  0  0  0
 28 48  1  0  0  0  0
 28 49  1  0  0  0  0
M  END
>  <SKU>
A16262

>  <Product Name>
PCI 29732

>  <CAS>
330786-25-9

>  <M.Wt>
371.43504

>  <Formula>
C22H21N5O

>  <Synonyms>
PCI29732, PCI-29732

>  <URL>
https://www.adooq.com/pci-29732.html

$$$$
