C,1,68.73,s,
C,2,83.47,s,
C,3,17.84,s,
C,4,28.55,s,
C,5,28.76,s,
C,6,24.81,s,
C,7,35.3,s,
C,8,169.84,s,
N,9,,,
C,10,150.51,s,
C,11,24.64,s,
C,12,31.9,s,
C,13,132.07,s,
C,14,120.94,s,
Cl,15,,,
C,16,29.79,s,
C,17,130.4,s,
C,18,119.0,s,
Cl,19,,,
C,20,113.58,s,
S,21,,,
H,22,2.09,s,
H,23,2.09,t,6.8
H,24,2.09,t,6.8
H,25,1.32,tt,"6.8,6.6"
H,26,1.32,tt,"6.8,6.6"
H,27,1.35,m,6.6
H,28,1.35,m,6.6
H,29,1.66,tt,"6.7,6.6"
H,30,1.66,tt,"6.7,6.6"
H,31,2.05,t,6.7
H,32,2.05,t,6.7
H,33,3.4,t,6.9
H,34,3.4,t,6.9
H,35,2.37,t,6.9
H,36,2.37,t,6.9
H,37,6.41,s,
H,38,3.07,d,7.0
H,39,3.07,d,7.0
H,40,6.44,dt,"13.0,7.0"
H,41,6.36,d,13.0
H,42,7.07,s,
