C,1,18.0,s,
C,2,142.0,s,
C,3,130.5,s,
C,4,,,
O,5,,,
C,6,58.38,s,
C,7,172.96,s,
O,8,,,
O,9,,,
C,10,83.9,s,
C,11,23.4,s,
C,12,189.3,s,
O,13,,,
C,14,110.1,s,
Cl,15,,,
C,16,140.6,s,
C,17,105.0,s,
C,18,155.24,s,
C,19,116.45,s,
C,20,140.7,s,
C,21,132.23,s,
C,22,14.31,s,
C,23,150.8,s,
C,24,34.6,s,
C,25,19.8,s,
C,26,29.4,s,
C,27,11.7,s,
O,28,,,
C,29,154.7,s,
C,30,114.4,s,
C,31,53.33,s,
H,32,1.87,d,7.0
H,33,1.87,d,7.0
H,34,1.87,d,7.0
H,35,6.91,dq,"16.0,7.0"
H,36,6.72,d,16.0
H,37,3.58,d,8.2
H,38,1.42,s,
H,39,1.42,s,
H,40,1.42,s,
H,41,6.72,s,
H,42,6.62,d,17.0
H,43,7.83,d,17.0
H,44,1.81,s,
H,45,1.81,s,
H,46,1.81,s,
H,47,5.58,d,7.0
H,48,2.47,dqt,"7.0,6.7,6.2"
H,49,0.98,d,6.7
H,50,0.98,d,6.7
H,51,0.98,d,6.7
H,52,1.44,qd,"7.0,6.2"
H,53,1.44,qd,"7.0,6.2"
H,54,0.88,t,7.0
H,55,0.88,t,7.0
H,56,0.88,t,7.0
H,57,7.79,s,
H,58,2.83,d,8.2
