C,1,11.76,s,
C,2,26.69,s,
C,3,41.07,s,
C,4,16.27,s,
C,5,175.75,s,
O,6,,,
O,7,,,
C,8,73.9,s,
C,9,79.7,s,
O,10,,,
C,11,172.7,s,
C,12,21.0,s,
O,13,,,
C,14,36.6,s,
C,15,24.45,s,
C,16,24.45,s,
C,17,48.1,s,
C,18,47.74,s,
C,19,149.11,s,
C,20,123.25,s,
C,21,23.77,s,
C,22,47.79,s,
C,23,36.92,s,
C,24,15.59,s,
C,25,38.52,s,
C,26,27.2,s,
C,27,78.78,s,
O,28,,,
C,29,38.55,s,
C,30,21.96,s,
C,31,21.96,s,
C,32,55.05,s,
C,33,18.17,s,
C,34,33.77,s,
C,35,43.99,s,
C,36,17.82,s,
C,37,41.86,s,
C,38,23.79,s,
C,39,77.86,s,
O,40,,,
C,41,77.86,s,
O,42,,,
C,43,41.86,s,
C,44,67.18,s,
O,45,,,
H,46,0.91,t,7.0
H,47,0.91,t,7.0
H,48,0.91,t,7.0
H,49,1.69,qd,"7.0,6.1"
H,50,1.69,qd,"7.0,6.1"
H,51,2.58,qt,"6.7,6.1"
H,52,1.14,d,6.7
H,53,1.14,d,6.7
H,54,1.14,d,6.7
H,55,4.77,s,
H,56,4.77,s,
H,57,2.0,s,
H,58,2.0,s,
H,59,2.0,s,
H,60,0.99,s,
H,61,0.99,s,
H,62,0.99,s,
H,63,0.99,s,
H,64,0.99,s,
H,65,0.99,s,
H,66,2.04,dd,"12.4,2.0"
H,67,2.04,dd,"12.4,11.1"
H,68,2.94,dd,"11.1,2.0"
H,69,5.45,dd,"3.9,3.6"
H,70,1.87,ddd,"15.4,11.8,3.9"
H,71,1.87,ddd,"15.4,7.2,3.6"
H,72,1.76,dd,"11.8,7.2"
H,73,0.88,s,
H,74,0.88,s,
H,75,0.88,s,
H,76,1.62,ddd,"12.4,12.3,5.6"
H,77,1.62,ddd,"12.4,6.4,2.7"
H,78,1.74,m,
H,79,1.74,m,
H,80,3.32,dd,"9.7,5.3"
H,81,,,
H,82,0.94,s,
H,83,0.94,s,
H,84,0.94,s,
H,85,0.94,s,
H,86,0.94,s,
H,87,0.94,s,
H,88,0.9,dd,"10.1,1.2"
H,89,1.46,dtd,"12.4,3.9,1.2"
H,90,1.46,m,
H,91,2.1,ddd,"12.4,3.9,3.8"
H,92,2.1,ddd,"14.5,12.4,3.9"
H,93,1.02,s,
H,94,1.02,s,
H,95,1.02,s,
H,96,1.87,s,
H,97,1.87,s,
H,98,1.87,s,
H,99,4.24,d,4.3
H,100,,,
H,101,4.53,d,4.3
H,102,,,
H,103,3.77,s,
H,104,3.77,s,
H,105,,,
