C,1,52.29,s,
O,2,,,
C,3,174.33,s,
O,4,,,
C,5,42.45,s,
C,6,25.73,s,
C,7,30.55,s,
C,8,34.7,s,
C,9,46.3,s,
C,10,180.0,s,
O,11,,,
O,12,,,
C,13,23.9,s,
C,14,28.0,s,
C,15,42.0,s,
C,16,26.1,s,
C,17,144.3,s,
C,18,123.3,s,
C,19,23.77,s,
C,20,47.45,s,
C,21,38.2,s,
C,22,17.2,s,
C,23,48.4,s,
C,24,68.8,s,
O,25,,,
C,26,77.0,s,
O,27,,,
C,28,104.8,s,
O,29,,,
C,30,76.5,s,
C,31,62.49,s,
O,32,,,
C,33,71.65,s,
O,34,,,
C,35,76.9,s,
O,36,,,
C,37,74.2,s,
O,38,,,
C,39,43.7,s,
C,40,14.9,s,
C,41,64.7,s,
O,42,,,
C,43,48.1,s,
C,44,18.3,s,
C,45,33.41,s,
C,46,40.03,s,
C,47,16.93,s,
C,48,43.0,s,
C,49,42.26,s,
H,50,3.75,s,
H,51,3.75,s,
H,52,3.75,s,
H,53,1.2,s,
H,54,1.2,s,
H,55,1.2,s,
H,56,1.82,ddd,"12.4,3.8,3.7"
H,57,1.82,ddd,"13.9,12.4,3.4"
H,58,1.76,ddd,"12.4,3.7,3.4"
H,59,1.76,ddd,"13.9,12.4,3.8"
H,60,,,
H,61,1.89,ddd,"12.4,8.5,1.6"
H,62,1.89,ddd,"12.4,10.7,8.8"
H,63,1.65,ddd,"12.4,10.7,8.5"
H,64,1.65,ddd,"12.4,8.8,1.6"
H,65,1.31,s,
H,66,1.31,s,
H,67,1.31,s,
H,68,5.48,dd,"3.8,3.6"
H,69,2.03,ddd,"15.4,12.8,3.6"
H,70,2.03,ddd,"15.4,6.9,3.8"
H,71,1.63,dd,"12.8,6.9"
H,72,1.5,s,
H,73,1.5,s,
H,74,1.5,s,
H,75,2.21,dd,"12.4,10.7"
H,76,2.21,dd,"12.4,4.5"
H,77,4.73,ddd,"10.7,4.5,3.0"
H,78,,,
H,79,4.3,d,3.0
H,80,5.1,d,6.9
H,81,3.63,td,"5.4,3.7"
H,82,4.04,d,5.4
H,83,4.04,d,5.4
H,84,,,
H,85,3.82,dd,"9.5,3.7"
H,86,,,
H,87,3.85,dd,"9.5,8.7"
H,88,,,
H,89,3.9,dd,"8.7,6.9"
H,90,,,
H,91,1.39,s,
H,92,1.39,s,
H,93,1.39,s,
H,94,4.24,s,
H,95,4.24,s,
H,96,,,
H,97,1.76,dd,"10.3,1.9"
H,98,1.52,m,
H,99,1.52,m,
H,100,1.47,ddd,"12.4,5.7,3.0"
H,101,1.47,ddd,"13.5,12.4,6.5"
H,102,1.08,s,
H,103,1.08,s,
H,104,1.08,s,
H,105,3.16,dd,"12.1,3.5"
H,106,2.04,dd,"12.4,12.1"
H,107,2.04,dd,"12.4,3.5"
