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,14,26.5,s,
C,15,23.76,s,
C,16,42.55,s,
C,17,,,
O,18,,,
C,19,43.13,s,
C,20,22.31,s,
C,21,37.4,s,
C,22,35.87,s,
C,23,20.91,s,
C,24,139.2,s,
C,25,126.34,s,
C,26,131.07,s,
C,27,143.41,s,
C,28,67.61,s,
O,29,,,
C,30,58.47,s,
C,31,26.83,s,
C,32,30.57,s,
C,33,73.9,s,
O,34,,,
C,35,72.9,s,
O,36,,,
C,37,36.0,s,
C,38,69.32,s,
O,39,,,
C,40,58.4,s,
N,41,,,
C,42,162.36,s,
O,43,,,
H,44,0.92,t,7.0
H,45,0.92,t,7.0
H,46,0.92,t,7.0
H,47,1.4,qt,"7.0,6.6"
H,48,1.4,qt,"7.0,6.6"
H,49,1.74,td,"6.6,6.0"
H,50,1.74,td,"6.6,6.0"
H,51,4.52,t,6.0
H,52,2.41,qdd,"6.7,4.1,3.9"
H,53,1.17,d,6.7
H,54,1.17,d,6.7
H,55,1.17,d,6.7
H,56,1.66,ddd,"12.4,7.7,4.1"
H,57,1.66,ddd,"12.4,3.9,1.1"
H,58,1.42,m,
H,59,0.84,d,6.4
H,60,0.84,d,6.4
H,61,0.84,d,6.4
H,62,1.23,m,
H,63,1.23,m,
H,64,1.34,m,
H,65,1.34,m,
H,66,1.64,m,
H,67,1.64,m,
H,68,2.42,ddd,"15.4,4.4,3.1"
H,69,2.42,ddd,"15.4,11.6,3.2"
H,70,2.41,ddd,"15.4,13.4,2.4"
H,71,2.41,ddd,"15.4,13.3,4.9"
H,72,1.52,m,
H,73,1.52,m,
H,74,1.58,m,
H,75,1.58,m,
H,76,2.46,m,
H,77,0.93,d,6.7
H,78,0.93,d,6.7
H,79,0.93,d,6.7
H,80,6.16,dd,"12.0,11.5"
H,81,6.38,dd,"12.0,3.1"
H,82,6.26,d,3.1
H,83,4.78,s,
H,84,4.78,s,
H,85,3.26,s,
H,86,3.26,s,
H,87,3.26,s,
H,88,2.44,ddd,"15.4,8.2,2.2"
H,89,2.44,ddd,"15.4,11.5,1.5"
H,90,1.8,m,
H,91,1.8,m,
H,92,3.81,ddd,"11.0,4.6,4.4"
H,93,,,
H,94,4.17,ddd,"8.0,4.6,0.4"
H,95,,,
H,96,2.14,ddd,"12.4,11.4,8.0"
H,97,2.14,ddd,"12.4,1.3,0.4"
H,98,4.11,tdd,"11.4,3.0,1.3"
H,99,,,
H,100,3.67,dd,"12.4,3.0"
H,101,3.67,dd,"12.4,11.4"
H,102,,,
