C,1,113.68,s,
C,2,148.06,s,
C,3,73.92,s,
O,4,,,
C,5,79.25,s,
O,6,,,
C,7,76.9,s,
C,8,28.64,s,
C,9,19.33,s,
C,10,19.33,s,
C,11,54.0,s,
C,12,138.89,s,
C,13,122.07,s,
C,14,170.33,s,
O,15,,,
O,16,,,
C,17,78.6,s,
C,18,45.2,s,
C,19,148.06,s,
C,20,113.68,s,
C,21,73.9,s,
O,22,,,
C,23,39.0,s,
C,24,42.38,s,
H,25,5.28,s,
H,26,5.28,s,
H,27,4.66,d,6.9
H,28,,,
H,29,4.66,dd,"6.9,1.2"
H,30,3.32,d,5.5
H,31,3.32,d,5.5
H,32,1.95,m,"6.4,5.5"
H,33,0.91,d,6.4
H,34,0.91,d,6.4
H,35,0.91,d,6.4
H,36,0.91,d,6.4
H,37,0.91,d,6.4
H,38,0.91,d,6.4
H,39,2.68,dd,"6.6,1.2"
H,40,5.94,s,
H,41,5.94,s,
H,42,4.6,dd,"7.5,6.6"
H,43,2.8,dd,"7.5,2.4"
H,44,5.28,s,
H,45,5.28,s,
H,46,4.31,dd,"9.8,9.4"
H,47,,,
H,48,2.01,ddd,"12.4,9.4,5.1"
H,49,2.01,ddd,"13.0,12.4,9.8"
H,50,2.99,ddd,"13.0,5.1,2.4"
