C,1,17.94,s,
C,2,135.81,s,
C,3,126.7,s,
C,4,127.92,s,
C,5,113.85,s,
C,6,156.64,s,
C,7,116.46,s,
C,8,,,
O,9,,,
C,10,41.86,s,
C,11,23.79,s,
C,12,88.44,s,
C,13,18.58,s,
C,14,35.55,s,
C,15,49.76,s,
N,16,,,
C,17,49.25,s,
C,18,22.4,s,
C,19,34.93,s,
C,20,70.6,s,
C,21,11.7,s,
O,22,,,
H,23,2.36,s,
H,24,2.36,s,
H,25,2.36,s,
H,26,7.18,dd,"6.8,1.4"
H,27,7.19,dd,"8.8,6.8"
H,28,6.95,dd,"8.8,1.4"
H,29,1.13,s,
H,30,1.13,s,
H,31,1.13,s,
H,32,1.4,s,
H,33,1.4,s,
H,34,1.4,s,
H,35,1.7,ddd,"12.4,11.2,5.8"
H,36,1.7,ddd,"12.4,10.8,2.8"
H,37,3.34,ddd,"12.4,10.8,5.8"
H,38,3.34,ddd,"12.4,11.2,2.8"
H,39,2.25,ddd,"11.1,9.4,5.5"
H,40,2.25,ddd,"10.0,9.4,3.3"
H,41,2.25,m,
H,42,2.25,m,
H,43,1.99,ddd,"12.4,10.1,1.6"
H,44,1.99,ddd,"12.4,9.9,9.8"
H,45,1.41,s,
H,46,1.41,s,
H,47,1.41,s,
