
 OpenBabel04291915453D

 59 61  0  0  0  0  0  0  0  0999 V2000
    3.0269   12.3981  -12.7243 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3097   11.5319  -11.8338 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0109   11.5327  -11.8330 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3395   10.7218  -10.9993 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0109    9.9101  -10.1664 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3538    9.9093  -10.1672 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0253    9.0977   -9.3342 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3682    9.0969   -9.3350 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0397    8.2852   -8.5021 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3826    8.2844   -8.5029 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9590   10.7469  -11.0283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0570   10.7227  -10.9985 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7553    9.8794  -10.1315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1415    9.1375   -9.3701 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1993    9.8803  -10.1307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8487    9.0961   -9.3244 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1474    9.0969   -9.3236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8189    9.9086  -10.1566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1474   10.7194  -10.9903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8708   10.6920  -10.9636 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8694    8.2250   -8.4272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2556    7.4830   -7.6658 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2659    8.2258   -8.4264 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9642    7.3826   -7.5594 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3071    7.3834   -7.5586 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9785    6.5725   -6.7249 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3215    6.5733   -6.7241 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9929    5.7625   -5.8904 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3358    5.7633   -5.8896 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0073    4.9524   -5.0559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3071    5.7609   -5.8920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0083    5.7601   -5.8927 N   0  3  0  0  0  0  0  0  0  0  0  0
   -7.2927    6.5709   -6.7265 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2911    4.8931   -5.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9414   -0.0566    0.0580 I   0  5  0  0  0  0  0  0  0  0  0  0
    0.9414   -0.0566    0.0580 I   0  5  0  0  0  0  0  0  0  0  0  0
    2.3316   12.9658  -13.3067 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6413   11.8113  -13.3747 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6428   13.0632  -12.1559 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4949   12.1564  -12.4731 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4949    9.2870   -9.5257 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5093    8.4745   -8.6936 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8842    9.7200   -9.9757 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5237    7.6621   -7.8614 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3331    8.0034   -8.2154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5493   11.3177  -11.6091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8509    9.9092  -10.1560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6500   11.3485  -11.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3414   11.3096  -11.5987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7582    8.8209   -9.0370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8231    8.0072   -8.1987 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8375    7.1971   -7.3642 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4769    5.1387   -5.2503 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8518    6.3870   -6.5297 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.8320    4.5202   -4.6109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2608    6.5602   -6.7167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9864    4.3262   -4.4199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6752    5.4791   -4.3533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6766    4.2272   -5.5722 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 37  1  0  0  0  0
  1 38  1  0  0  0  0
  1 39  1  0  0  0  0
  2  3  2  0  0  0  0
  2 11  1  0  0  0  0
  3  4  1  0  0  0  0
  3 40  1  0  0  0  0
  4 12  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5 41  1  0  0  0  0
  6  7  2  0  0  0  0
  6 11  1  0  0  0  0
  7  8  1  0  0  0  0
  7 42  1  0  0  0  0
  8  9  2  0  0  0  0
  8 43  1  0  0  0  0
  9 10  1  0  0  0  0
  9 44  1  0  0  0  0
 10 11  2  0  0  0  0
 10 45  1  0  0  0  0
 12 13  1  0  0  0  0
 12 46  1  0  0  0  0
 13 15  1  0  0  0  0
 13 14  2  0  0  0  0
 15 16  2  0  0  0  0
 15 20  1  0  0  0  0
 16 17  1  0  0  0  0
 17 21  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 47  1  0  0  0  0
 19 20  2  0  0  0  0
 19 48  1  0  0  0  0
 20 49  1  0  0  0  0
 21 23  1  0  0  0  0
 21 22  2  0  0  0  0
 23 24  1  0  0  0  0
 23 50  1  0  0  0  0
 24 25  2  0  0  0  0
 24 33  1  0  0  0  0
 25 26  1  0  0  0  0
 25 51  1  0  0  0  0
 26 27  2  0  0  0  0
 26 31  1  0  0  0  0
 27 28  1  0  0  0  0
 27 52  1  0  0  0  0
 28 29  2  0  0  0  0
 28 53  1  0  0  0  0
 29 30  1  0  0  0  0
 29 54  1  0  0  0  0
 30 31  2  0  0  0  0
 30 55  1  0  0  0  0
 31 32  1  0  0  0  0
 32 34  1  0  0  0  0
 32 33  2  0  0  0  0
 33 56  1  0  0  0  0
 34 57  1  0  0  0  0
 34 58  1  0  0  0  0
 34 59  1  0  0  0  0
M  CHG  4   2   1  32   1  35  -1  36  -1
M  END
>  <SKU>
A14976

>  <Product Name>
360A iodide

>  <CAS>
737763-37-0

>  <M.Wt>
703.31276

>  <Formula>
C27H23I2N5O2

>  <Synonyms>
360 A iodide

>  <URL>
https://www.adooq.com/360a-iodide.html

$$$$
