ecatasy.mol


 29 30  0  0  0                 1 V2000
   -0.5491    1.6495   -0.1465 C   0  0  0  0  0
   -1.8475    1.5732    0.3472 C   0  0  0  0  0
   -2.2157    0.6065    1.2762 C   0  0  0  0  0
   -1.2968   -0.3253    1.7450 C   0  0  0  0  0
    0.0121   -0.2422    1.2545 C   0  0  0  0  0
    0.4046    0.7251    0.3126 C   0  0  0  0  0
   -2.9424    2.3694    0.0653 O   0  0  0  0  0
   -4.0338    1.8923    0.8588 C   0  0  0  0  0
   -3.5489    0.7686    1.6007 O   0  0  0  0  0
    1.8242    0.8440   -0.2077 C   0  0  0  0  0
    2.7767   -0.3456    0.0139 C   0  0  0  0  0
    4.1805   -0.0408   -0.5381 C   0  0  0  0  0
    2.2551   -1.6186   -0.4986 N   0  0  0  0  0
    2.0558   -1.6893   -1.9436 C   0  0  0  0  0
   -0.2827    2.4358   -0.8690 H   0  0  0  0  0
   -1.5907   -1.0837    2.4859 H   0  0  0  0  0
    0.7406   -0.9639    1.6527 H   0  0  0  0  0
   -4.8589    1.5609    0.1893 H   0  0  0  0  0
   -4.3437    2.6913    1.5696 H   0  0  0  0  0
    2.2636    1.7427    0.2888 H   0  0  0  0  0
    1.7879    1.0808   -1.2963 H   0  0  0  0  0
    2.9063   -0.4827    1.1179 H   0  0  0  0  0
    4.6431    0.8165    0.0023 H   0  0  0  0  0
    4.1582    0.2321   -1.6164 H   0  0  0  0  0
    4.8590   -0.9160   -0.4171 H   0  0  0  0  0
    2.9031   -2.3600   -0.2300 H   0  0  0  0  0
    1.3313   -0.9230   -2.2962 H   0  0  0  0  0
    1.6388   -2.6913   -2.1947 H   0  0  0  0  0
    3.0210   -1.5855   -2.4859 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1 15  1  6  0  0
  2  3  1  1  0  0
  2  7  1  0  0  0
  3  4  2  0  0  0
  3  9  1  0  0  0
  4  5  1  0  0  0
  4 16  1  1  0  0
  5  6  2  0  0  0
  5 17  1  0  0  0
  6 10  1  0  0  0
  7  8  1  1  0  0
  8  9  1  1  0  0
  8 18  1  6  0  0
  8 19  1  1  0  0
 10 11  1  0  0  0
 10 20  1  0  0  0
 10 21  1  6  0  0
 11 12  1  0  0  0
 11 13  1  0  0  0
 11 22  1  1  0  0
 12 23  1  1  0  0
 12 24  1  6  0  0
 12 25  1  0  0  0
 13 14  1  6  0  0
 13 26  1  0  0  0
 14 27  1  0  0  0
 14 28  1  0  0  0
 14 29  1  6  0  0
M  END