C,1,15.2,s,
S,2,,,
C,3,162.1,s,
N,4,,,
C,5,132.1,s,
C,6,121.45,s,
C,7,132.65,s,
C,8,128.43,s,
C,9,115.84,s,
C,10,156.85,s,
O,11,,,
C,12,115.84,s,
C,13,128.43,s,
S,14,,,
C,15,15.2,s,
H,16,2.58,s,
H,17,2.58,s,
H,18,2.58,s,
H,19,6.9,d,14.0
H,20,5.91,d,14.0
H,21,7.26,ddd,"6.9,1.9,0.5"
H,22,6.75,ddd,"6.9,1.9,0.5"
H,23,,,
H,24,6.75,ddd,"7.4,1.9,0.5"
H,25,7.26,ddd,"7.4,1.9,0.5"
H,26,2.58,s,
H,27,2.58,s,
H,28,2.58,s,
