axidmingp
  Cerius2 01209718263D 1   1.00000                          
Structure written by MSI SD Exporter
 54 52  0  0  0
   -1.8433    2.9453    5.4003 C   0  0  0  0  0  0
   -1.1350    3.9806    5.8162 N   0  0  0  0  0  0
   -1.0110    4.9245    4.8006 C   0  0  0  0  0  0
   -1.6507    4.5768    3.6250 C   0  0  0  0  0  0
   -2.3968    3.0443    3.7745 S   0  0  0  0  0  0
   -2.1595    1.7272    6.2398 C   0  0  0  0  0  0
   -3.5421    1.7121    6.7682 N   0  0  0  0  0  0
   -3.7271    2.7665    7.7721 C   0  0  0  0  0  0
   -3.8224    0.4075    7.3711 C   0  0  0  0  0  0
   -0.2872    6.2084    5.0680 C   0  0  0  0  0  0
    1.4742    5.9713    5.4695 S   0  0  0  0  0  0
    2.2506    6.2676    3.8383 C   0  0  0  0  0  0
    1.9057    5.2376    2.7599 C   0  0  0  0  0  0
    2.1957    3.8738    3.1974 N   0  0  0  0  0  0
    1.5637    2.7525    2.6852 C   0  0  0  0  0  0
    1.2305    1.6637    3.4108 C   0  0  0  0  0  0
    1.2819    2.8056    1.3252 N   0  0  0  0  0  0
    0.8815    1.6966    0.4814 C   0  0  0  0  0  0
    1.4900    1.5320    4.8234 N   0  0  0  0  0  0
    2.2122    2.3545    5.4016 O   0  0  0  0  0  0
    0.9618    0.5531    5.3774 O   0  0  0  0  0  0
   -1.7156    5.1349    2.7022 H   0  0  0  0  0  0
   -2.0031    0.8419    5.6091 H   0  0  0  0  0  0
   -1.4301    1.6551    7.0574 H   0  0  0  0  0  0
   -3.0389    2.6585    8.6181 H   0  0  0  0  0  0
   -3.5907    3.7613    7.3348 H   0  0  0  0  0  0
   -4.7515    2.7442    8.1619 H   0  0  0  0  0  0
   -3.1419    0.1768    8.1991 H   0  0  0  0  0  0
   -4.8505    0.3688    7.7480 H   0  0  0  0  0  0
   -3.7362   -0.3885    6.6226 H   0  0  0  0  0  0
   -0.3881    6.9051    4.2294 H   0  0  0  0  0  0
   -0.7543    6.6896    5.9347 H   0  0  0  0  0  0
    1.9881    7.2748    3.4979 H   0  0  0  0  0  0
    3.3334    6.2598    4.0052 H   0  0  0  0  0  0
    0.8545    5.3414    2.4737 H   0  0  0  0  0  0
    2.4990    5.4558    1.8643 H   0  0  0  0  0  0
    2.3058    3.8188    4.2214 H   0  0  0  0  0  0
    0.7210    0.7896    3.0402 H   0  0  0  0  0  0
    1.9416    3.4316    0.8701 H   0  0  0  0  0  0
    0.7422    2.0507   -0.5447 H   0  0  0  0  0  0
    1.6488    0.9164    0.4726 H   0  0  0  0  0  0
   -0.0684    1.2695    0.8179 H   0  0  0  0  0  0
    0.7521    3.6044    8.6814 C   0  0  0  0  0  0
   -0.5748    4.0820    8.5427 O   0  0  0  0  0  0
    1.4535    4.3577    8.3172 H   0  0  0  0  0  0
    0.9489    3.4104    9.7384 H   0  0  0  0  0  0
    0.8676    2.6765    8.1165 H   0  0  0  0  0  0
   -0.7175    4.1908    7.5762 H   0  0  0  0  0  0
   -0.5841   -1.2894    4.0192 O   0  0  0  0  0  0
   -1.3191   -2.3647    4.5755 C   0  0  0  0  0  0
   -0.0661   -0.9008    4.7551 H   0  0  0  0  0  0
   -0.6282   -3.1030    4.9902 H   0  0  0  0  0  0
   -1.9183   -2.8304    3.7895 H   0  0  0  0  0  0
   -1.9799   -1.9873    5.3596 H   0  0  0  0  0  0
  2  1  2  0  0  0
  3  2  1  0  0  0
  4  3  2  0  0  0
  5  4  1  0  0  0
  1  5  1  0  0  0
  6  1  1  0  0  0
  7  6  1  0  0  0
  8  7  1  0  0  0
  9  7  1  0  0  0
 10  3  1  0  0  0
 11 10  1  0  0  0
 12 11  1  0  0  0
 13 12  1  0  0  0
 14 13  1  0  0  0
 15 14  1  0  0  0
 16 15  2  0  0  0
 17 15  1  0  0  0
 18 17  1  0  0  0
 19 20  2  0  0  0
 19 21  1  0  0  0
 16 19  1  0  0  0
 22  4  1  0  0  0
 23  6  1  0  0  0
 24  6  1  0  0  0
 25  8  1  0  0  0
 26  8  1  0  0  0
 27  8  1  0  0  0
 28  9  1  0  0  0
 29  9  1  0  0  0
 30  9  1  0  0  0
 31 10  1  0  0  0
 32 10  1  0  0  0
 33 12  1  0  0  0
 34 12  1  0  0  0
 35 13  1  0  0  0
 36 13  1  0  0  0
 37 14  1  0  0  0
 38 16  1  0  0  0
 39 17  1  0  0  0
 40 18  1  0  0  0
 41 18  1  0  0  0
 42 18  1  0  0  0
 44 43  1  0  0  0
 45 43  1  0  0  0
 46 43  1  0  0  0
 47 43  1  0  0  0
 48 44  1  0  0  0
 50 49  1  0  0  0
 51 49  1  0  0  0
 54 50  1  0  0  0
 52 50  1  0  0  0
 53 50  1  0  0  0
$$$$