C,1,10.15,s,
C,2,25.8,s,
C,3,70.48,s,
O,4,,,
C,5,79.7,s,
C,6,34.15,s,
C,7,125.92,s,
C,8,131.8,s,
C,9,26.0,s,
C,10,127.7,s,
C,11,130.41,s,
C,12,26.84,s,
C,13,28.65,s,
C,14,29.09,s,
C,15,28.1,s,
C,16,27.3,s,
C,17,24.9,s,
C,18,34.1,s,
C,19,174.9,s,
O,20,,,
O,21,,,
H,22,0.9,t,7.0
H,23,0.9,t,7.0
H,24,0.9,t,7.0
H,25,1.67,qd,"7.0,5.6"
H,26,1.67,qd,"7.0,5.6"
H,27,4.17,td,"5.6,4.7"
H,28,,,
H,29,4.61,ddd,"6.2,4.7,3.1"
H,30,2.57,ddd,"15.4,6.2,4.2"
H,31,2.57,ddd,"15.4,11.3,3.1"
H,32,5.39,ddd,"11.3,11.0,4.2"
H,33,5.51,ddd,"11.0,7.3,3.4"
H,34,2.45,ddd,"18.4,11.2,7.3"
H,35,2.45,ddd,"18.4,4.0,3.4"
H,36,5.51,ddd,"11.2,11.0,4.0"
H,37,5.4,ddd,"11.0,8.0,2.9"
H,38,2.0,m,
H,39,2.0,m,
H,40,1.31,m,
H,41,1.31,m,
H,42,1.3,m,
H,43,1.3,m,
H,44,1.25,m,
H,45,1.25,m,
H,46,1.27,m,
H,47,1.27,m,
H,48,1.46,m,
H,49,1.46,m,
H,50,2.31,ddd,"15.4,10.8,8.4"
H,51,2.31,ddd,"15.4,7.3,2.2"
