C,1,22.85,s,
C,2,25.63,s,
C,3,22.85,s,
C,4,43.67,s,
C,5,172.44,s,
O,6,,,
O,7,,,
C,8,65.6,s,
C,9,41.19,s,
C,10,28.16,s,
C,11,23.65,s,
C,12,143.15,s,
C,13,40.38,s,
C,14,23.96,s,
C,15,40.03,s,
C,16,19.5,s,
C,17,39.3,s,
C,18,31.0,s,
C,19,30.15,s,
C,20,30.15,s,
C,21,48.86,s,
C,22,141.77,s,
C,23,33.14,s,
C,24,58.87,s,
C,25,171.85,s,
O,26,,,
O,27,,,
C,28,73.63,s,
C,29,48.27,s,
H,30,0.98,d,6.4
H,31,0.98,d,6.4
H,32,0.98,d,6.4
H,33,1.95,m,"6.4,6.0"
H,34,0.98,d,6.4
H,35,0.98,d,6.4
H,36,0.98,d,6.4
H,37,2.16,d,6.0
H,38,2.16,d,6.0
H,39,4.02,d,5.8
H,40,4.02,d,5.8
H,41,2.3,m,
H,42,1.58,m,
H,43,1.58,m,
H,44,2.19,ddd,"15.4,7.6,1.2"
H,45,2.19,ddd,"15.4,11.8,7.4"
H,46,1.18,s,
H,47,1.18,s,
H,48,1.18,s,
H,49,1.72,ddd,"13.2,12.4,4.9"
H,50,1.72,ddd,"12.4,3.9,3.0"
H,51,1.42,m,
H,52,1.42,m,
H,53,1.72,ddd,"12.9,12.4,2.9"
H,54,1.72,ddd,"12.4,3.1,2.2"
H,55,0.94,s,
H,56,0.94,s,
H,57,0.94,s,
H,58,0.94,s,
H,59,0.94,s,
H,60,0.94,s,
H,61,2.06,s,
H,62,2.06,s,
H,63,2.44,dd,"12.4,11.0"
H,64,2.44,dd,"12.4,1.8"
H,65,3.84,ddd,"11.0,8.3,1.8"
H,66,4.52,dd,"8.3,0.5"
H,67,2.8,dd,"11.4,0.5"
