trans-Thioethanol
  -ISIS-            3D
s95 C2H6S CCS
  9  8  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 S   0  0  0  0  0
    1.7735    0.0000    0.0000 C   0  0  0  0  0
    2.2206    1.4321    0.0000 C   0  0  0  0  0
   -0.2113   -1.3034   -0.0000 H   0  0  0  0  0
    2.1582   -0.5328   -0.9028 H   0  0  0  0  0
    2.1584   -0.5329    0.9026 H   0  0  0  0  0
    3.3375    1.4834    0.0000 H   0  0  0  0  0
    1.8430    1.9663    0.9062 H   0  0  0  0  0
    1.8439    1.9658   -0.9069 H   0  0  0  0  0
  1  2  1  0  0  0
  1  4  1  0  0  0
  2  3  1  0  0  0
  2  5  1  0  0  0
  2  6  1  0  0  0
  3  7  1  0  0  0
  3  8  1  0  0  0
  3  9  1  0  0  0
M  END