C,1,15.38,s,
C,2,65.41,s,
O,3,,,
C,4,76.56,s,
C,5,23.8,s,
C,6,48.76,s,
C,7,39.26,s,
C,8,22.07,s,
C,9,22.07,s,
C,10,80.55,s,
O,11,,,
C,12,170.83,s,
C,13,21.21,s,
O,14,,,
C,15,24.85,s,
C,16,36.2,s,
C,17,37.09,s,
C,18,19.77,s,
C,19,143.15,s,
C,20,141.82,s,
C,21,41.86,s,
C,22,23.79,s,
C,23,78.41,s,
O,24,,,
C,25,170.18,s,
C,26,21.24,s,
O,27,,,
C,28,35.12,s,
C,29,50.54,s,
C,30,39.3,s,
C,31,13.55,s,
C,32,77.06,s,
C,33,33.8,s,
C,34,145.65,s,
C,35,127.16,s,
C,36,15.35,s,
C,37,172.63,s,
O,38,,,
O,39,,,
O,40,,,
C,41,170.21,s,
C,42,21.23,s,
O,43,,,
C,44,43.99,s,
C,45,17.82,s,
C,46,31.35,s,
C,47,20.52,s,
H,48,1.24,t,6.7
H,49,1.24,t,6.7
H,50,1.24,t,6.7
H,51,3.61,q,6.7
H,52,3.61,q,6.7
H,53,5.61,dd,"6.4,3.2"
H,54,2.0,ddd,"12.4,11.2,6.4"
H,55,2.0,ddd,"12.4,4.7,3.2"
H,56,2.11,dd,"11.2,4.7"
H,57,1.07,s,
H,58,1.07,s,
H,59,1.07,s,
H,60,1.07,s,
H,61,1.07,s,
H,62,1.07,s,
H,63,4.47,dd,"10.2,2.4"
H,64,2.01,s,
H,65,2.01,s,
H,66,2.01,s,
H,67,1.83,m,
H,68,1.83,m,
H,69,1.71,ddd,"12.4,11.8,1.6"
H,70,1.71,ddd,"12.4,12.0,4.1"
H,71,1.1,s,
H,72,1.1,s,
H,73,1.1,s,
H,74,1.87,s,
H,75,1.87,s,
H,76,1.87,s,
H,77,4.77,dd,"10.6,3.8"
H,78,2.01,s,
H,79,2.01,s,
H,80,2.01,s,
H,81,1.88,ddd,"12.4,10.6,4.0"
H,82,1.88,ddd,"12.4,11.1,3.8"
H,83,1.61,ddd,"11.1,5.6,4.0"
H,84,2.11,qdd,"6.6,5.6,5.1"
H,85,1.05,d,6.6
H,86,1.05,d,6.6
H,87,1.05,d,6.6
H,88,4.88,td,"6.0,5.1"
H,89,2.44,dd,"7.0,6.0"
H,90,2.44,dd,"7.0,6.0"
H,91,7.74,t,7.0
H,92,1.91,s,
H,93,1.91,s,
H,94,1.91,s,
H,95,,,
H,96,2.02,s,
H,97,2.02,s,
H,98,2.02,s,
H,99,1.02,s,
H,100,1.02,s,
H,101,1.02,s,
H,102,1.96,ddd,"12.4,6.8,1.1"
H,103,1.96,ddd,"13.3,12.4,2.9"
H,104,2.1,ddd,"15.4,13.3,1.1"
H,105,2.1,ddd,"15.4,6.8,2.9"
