C,1,10.48,s,
C,2,26.92,s,
C,3,77.06,s,
O,4,,,
C,5,171.34,s,
O,6,,,
C,7,38.7,s,
C,8,71.11,s,
O,9,,,
C,10,40.7,s,
C,11,11.6,s,
C,12,81.59,s,
O,13,,,
C,14,102.46,s,
O,15,,,
C,16,72.7,s,
C,17,20.86,s,
C,18,36.08,s,
C,19,63.83,s,
N,20,,,
C,21,41.56,s,
C,22,41.56,s,
C,23,73.63,s,
O,24,,,
C,25,38.43,s,
C,26,30.5,s,
C,27,84.68,s,
O,28,,,
S,29,,,
C,30,34.51,s,
C,31,53.94,s,
N,32,,,
C,33,173.28,s,
O,34,,,
O,35,,,
C,36,32.61,s,
C,37,43.68,s,
C,38,15.6,s,
C,39,,,
O,40,,,
C,41,129.35,s,
C,42,135.73,s,
C,43,59.9,s,
C,44,16.4,s,
O,45,,,
C,46,73.63,s,
C,47,38.31,s,
C,48,12.71,s,
H,49,0.88,t,7.0
H,50,0.88,t,7.0
H,51,0.88,t,7.0
H,52,1.45,qd,"7.0,5.7"
H,53,1.45,qd,"7.0,5.7"
H,54,5.34,dt,"5.9,5.7"
H,55,2.67,dd,"15.4,7.4"
H,56,2.67,dd,"15.4,0.7"
H,57,4.19,ddd,"7.4,5.7,0.7"
H,58,,,
H,59,1.8,qdd,"6.6,5.7,5.6"
H,60,1.03,d,6.6
H,61,1.03,d,6.6
H,62,1.03,d,6.6
H,63,4.74,dd,"5.6,3.9"
H,64,4.28,d,8.5
H,65,4.53,dqd,"6.9,6.0,1.5"
H,66,1.29,d,6.0
H,67,1.29,d,6.0
H,68,1.29,d,6.0
H,69,2.2,ddd,"12.4,11.8,6.9"
H,70,2.2,ddd,"12.4,5.7,1.5"
H,71,3.41,ddd,"11.8,10.8,5.7"
H,72,2.84,s,
H,73,2.84,s,
H,74,2.84,s,
H,75,2.84,s,
H,76,2.84,s,
H,77,2.84,s,
H,78,3.93,dd,"10.8,8.5"
H,79,,,
H,80,2.64,m,
H,81,2.05,dd,"6.1,5.6"
H,82,2.05,dd,"6.1,5.6"
H,83,5.34,t,5.6
H,84,,,
H,85,3.23,d,6.2
H,86,3.23,d,6.2
H,87,3.95,t,6.2
H,88,,,
H,89,,,
H,90,,,
H,91,1.66,ddd,"12.4,7.3,2.7"
H,92,1.66,ddd,"12.4,5.7,4.5"
H,93,2.78,dqd,"7.3,6.6,4.5"
H,94,1.12,d,6.6
H,95,1.12,d,6.6
H,96,1.12,d,6.6
H,97,6.38,d,12.0
H,98,5.99,d,12.0
H,99,1.42,s,
H,100,1.42,s,
H,101,1.42,s,
H,102,4.52,d,5.3
H,103,1.8,qdd,"6.6,5.9,5.3"
H,104,0.88,d,6.6
H,105,0.88,d,6.6
H,106,0.88,d,6.6
