
 OpenBabel04291915353D

101105  0  0  0  0  0  0  0  0999 V2000
   -4.4066  -20.8528  -10.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9612  -20.0740  -11.7981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8445  -20.4052  -12.9410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5181  -19.4899  -13.5097 N   0  3  0  0  0  0  0  0  0  0  0  0
   -6.3504  -19.8020  -14.5867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8403  -21.9701  -18.1285 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1285  -22.9374  -17.5276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2171  -24.2049  -17.9624 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0175  -24.5050  -18.9981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1061  -25.7725  -19.4329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6163  -23.6045  -15.8911 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3281  -22.6372  -16.4920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2394  -21.3697  -16.0572 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4390  -21.0695  -15.0215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4234  -18.1359  -13.0452 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3216  -17.2467  -13.8895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2213  -15.8121  -13.3974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1196  -14.9229  -14.2417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0002  -13.2145  -13.6556 S   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4421  -13.1452  -12.1966 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5557  -12.7363  -13.7729 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0107  -12.2141  -14.6055 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.9829  -20.0823  -11.8281 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8953  -18.8419  -11.4034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0338  -18.5189  -10.2905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9462  -17.2785   -9.8658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0846  -16.9555   -8.7529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9971  -15.7151   -8.3281 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1355  -15.3921   -7.2153 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0480  -14.1517   -6.7905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8326  -13.0840   -7.4544 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4451  -13.0016   -8.8825 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1743  -12.7271   -9.2187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2156  -13.8395   -5.7135 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5438  -14.8730   -5.0709 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3603  -14.2721   -3.9383 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1650  -15.3671   -3.2574 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9815  -14.7662   -2.1249 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9397  -16.0702   -1.3140 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.9903  -17.1249   -0.7526 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8773  -16.7183   -2.3288 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8583  -15.3941   -0.0399 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.1768  -12.6525  -10.5128 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4477  -12.3780  -10.8490 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7988  -12.3033  -12.1430 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0696  -12.0288  -12.4792 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4207  -11.9541  -13.7733 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6916  -11.6796  -14.1094 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0427  -11.6050  -15.4035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3649  -13.2015   -9.8404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3147  -13.4044   -7.3492 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5525  -11.7530   -6.7759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0431  -18.5838  -11.5097 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9669   -0.0923    0.0197 Na  0  3  0  0  0 15  0  0  0  0  0  0
   -3.7732  -20.6083   -9.7441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3423  -21.9018  -10.7718 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4180  -20.5964  -10.3337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6701  -24.9482  -17.5007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5645  -23.7617  -19.4599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4315  -26.5529  -20.0247 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9420  -23.7805  -15.1298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7864  -20.6263  -16.5189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8920  -21.8129  -14.5597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4106  -17.8006  -13.1275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7332  -18.0873  -12.0222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3344  -17.5820  -13.8073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0118  -17.2953  -14.9125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2086  -15.4768  -13.4796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5312  -15.7635  -12.3744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1324  -15.2582  -14.1594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8098  -14.9715  -15.2647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4359  -20.8256  -11.3664 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4423  -18.0985  -11.8652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4868  -19.2622   -9.8287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4932  -16.5351  -10.3275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5376  -17.6989   -8.2911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5441  -14.9717   -8.7899 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5885  -16.1355   -6.7535 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2012  -15.3275   -5.7824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1219  -15.6125   -4.6772 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7029  -13.8176   -3.2268 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0260  -13.5326   -4.3320 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8224  -15.8216   -3.9689 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4993  -16.1066   -2.8638 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3241  -14.3118   -1.4134 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6472  -14.0267   -2.5185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5300  -12.8060  -11.2489 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1545  -12.2244  -10.1128 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7764  -11.8752  -11.7431 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7139  -12.1077  -14.5094 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3984  -11.5261  -13.3733 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6157  -11.4819  -16.2529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5944  -13.4639   -6.3182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5118  -14.3414   -7.8269 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8811  -12.6336   -7.8286 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8323  -11.8125   -5.7448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1190  -10.9821   -7.2552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5092  -11.5275   -6.8499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4054  -18.3447  -10.6844 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0521  -18.3223  -11.2681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7295  -18.0356  -12.3734 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 55  1  0  0  0  0
  1 56  1  0  0  0  0
  1 57  1  0  0  0  0
  2 53  1  0  0  0  0
  2  3  1  0  0  0  0
  2  6  1  0  0  0  0
  3 23  1  0  0  0  0
  3  4  2  0  0  0  0
  4 15  1  0  0  0  0
  4  5  1  0  0  0  0
  5 14  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7 12  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 58  1  0  0  0  0
  9 10  2  0  0  0  0
  9 59  1  0  0  0  0
 10 11  1  0  0  0  0
 10 60  1  0  0  0  0
 11 12  2  0  0  0  0
 11 61  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 62  1  0  0  0  0
 14 63  1  0  0  0  0
 15 16  1  0  0  0  0
 15 64  1  0  0  0  0
 15 65  1  0  0  0  0
 16 17  1  0  0  0  0
 16 66  1  0  0  0  0
 16 67  1  0  0  0  0
 17 18  1  0  0  0  0
 17 68  1  0  0  0  0
 17 69  1  0  0  0  0
 18 19  1  0  0  0  0
 18 70  1  0  0  0  0
 18 71  1  0  0  0  0
 19 22  1  0  0  0  0
 19 21  2  0  0  0  0
 19 20  2  0  0  0  0
 23 24  2  0  0  0  0
 23 72  1  0  0  0  0
 24 25  1  0  0  0  0
 24 73  1  0  0  0  0
 25 26  2  0  0  0  0
 25 74  1  0  0  0  0
 26 27  1  0  0  0  0
 26 75  1  0  0  0  0
 27 28  2  0  0  0  0
 27 76  1  0  0  0  0
 28 29  1  0  0  0  0
 28 77  1  0  0  0  0
 29 30  2  0  0  0  0
 29 78  1  0  0  0  0
 30 31  1  0  0  0  0
 30 34  1  0  0  0  0
 31 52  1  0  0  0  0
 31 51  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 32 50  1  0  0  0  0
 33 43  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 35 79  1  0  0  0  0
 35 80  1  0  0  0  0
 36 37  1  0  0  0  0
 36 81  1  0  0  0  0
 36 82  1  0  0  0  0
 37 38  1  0  0  0  0
 37 83  1  0  0  0  0
 37 84  1  0  0  0  0
 38 39  1  0  0  0  0
 38 85  1  0  0  0  0
 38 86  1  0  0  0  0
 39 42  1  0  0  0  0
 39 41  2  0  0  0  0
 39 40  2  0  0  0  0
 43 44  2  0  0  0  0
 43 87  1  0  0  0  0
 44 45  1  0  0  0  0
 44 88  1  0  0  0  0
 45 46  2  0  0  0  0
 45 50  1  0  0  0  0
 46 47  1  0  0  0  0
 46 89  1  0  0  0  0
 47 48  2  0  0  0  0
 47 90  1  0  0  0  0
 48 49  1  0  0  0  0
 48 91  1  0  0  0  0
 49 50  2  0  0  0  0
 49 92  1  0  0  0  0
 51 93  1  0  0  0  0
 51 94  1  0  0  0  0
 51 95  1  0  0  0  0
 52 96  1  0  0  0  0
 52 97  1  0  0  0  0
 52 98  1  0  0  0  0
 53 99  1  0  0  0  0
 53100  1  0  0  0  0
 53101  1  0  0  0  0
M  CHG  4   4   1  22  -1  42  -1  54   1
M  END
>  <SKU>
A10472

>  <Product Name>
Indocyanine green

>  <CAS>
3599-32-4

>  <M.Wt>
774.96285

>  <Formula>
C43H47N2NaO6S2

>  <Synonyms>
Cardiogreen, IR-125

>  <URL>
https://www.adooq.com/indocyanine-green.html

$$$$
