C,1,13.91,s,
C,2,18.58,s,
C,3,33.45,s,
C,4,73.63,s,
O,5,,,
C,6,175.75,s,
O,7,,,
C,8,37.2,s,
C,9,17.5,s,
C,10,40.9,s,
C,11,30.4,s,
C,12,19.76,s,
C,13,36.44,s,
C,14,27.18,s,
C,15,29.1,s,
C,16,29.1,s,
C,17,27.1,s,
C,18,34.7,s,
C,19,45.3,s,
C,20,28.4,s,
C,21,11.9,s,
C,22,139.64,s,
C,23,126.34,s,
C,24,131.07,s,
C,25,143.41,s,
C,26,67.61,s,
O,27,,,
C,28,58.47,s,
C,29,26.83,s,
C,30,30.57,s,
C,31,73.9,s,
O,32,,,
C,33,72.9,s,
O,34,,,
C,35,36.0,s,
C,36,69.32,s,
O,37,,,
C,38,58.4,s,
N,39,,,
C,40,162.36,s,
O,41,,,
H,42,0.92,t,7.0
H,43,0.92,t,7.0
H,44,0.92,t,7.0
H,45,1.4,qt,"7.0,6.6"
H,46,1.4,qt,"7.0,6.6"
H,47,1.74,td,"6.6,6.0"
H,48,1.74,td,"6.6,6.0"
H,49,4.52,t,6.0
H,50,2.41,ddq,"11.9,6.9,6.7"
H,51,1.17,d,6.7
H,52,1.17,d,6.7
H,53,1.17,d,6.7
H,54,1.66,ddd,"12.4,11.9,4.8"
H,55,1.66,ddd,"12.4,11.3,6.9"
H,56,1.42,m,
H,57,0.84,d,6.4
H,58,0.84,d,6.4
H,59,0.84,d,6.4
H,60,1.23,m,
H,61,1.23,m,
H,62,1.26,m,
H,63,1.26,m,
H,64,1.28,m,
H,65,1.28,m,
H,66,1.28,m,
H,67,1.28,m,
H,68,1.34,m,
H,69,1.34,m,
H,70,1.58,m,
H,71,1.58,m,
H,72,1.56,m,
H,73,1.26,qd,"7.0,6.2"
H,74,1.26,qd,"7.0,6.2"
H,75,0.76,t,7.0
H,76,0.76,t,7.0
H,77,0.76,t,7.0
H,78,6.16,dd,"12.0,11.5"
H,79,6.38,dd,"12.0,3.4"
H,80,6.26,d,3.4
H,81,4.78,s,
H,82,4.78,s,
H,83,3.26,s,
H,84,3.26,s,
H,85,3.26,s,
H,86,2.44,ddd,"15.4,11.6,1.9"
H,87,2.44,ddd,"15.4,8.7,1.8"
H,88,1.8,m,
H,89,1.8,m,
H,90,3.81,ddd,"9.8,9.6,3.8"
H,91,,,
H,92,4.17,ddd,"9.6,8.0,1.0"
H,93,,,
H,94,2.14,ddd,"12.4,10.1,8.0"
H,95,2.14,ddd,"12.4,1.2,1.0"
H,96,4.11,m,
H,97,,,
H,98,3.67,dd,"12.4,11.4"
H,99,3.67,dd,"12.4,5.5"
H,100,,,
