C,1,52.08,s,
O,2,,,
C,3,172.96,s,
O,4,,,
C,5,40.4,s,
C,6,142.78,s,
C,7,128.7,s,
C,8,132.29,s,
C,9,110.32,s,
C,10,155.0,s,
O,11,,,
C,12,126.72,s,
C,13,75.98,s,
O,14,,,
C,15,100.5,s,
C,16,33.7,s,
C,17,63.83,s,
N,18,,,
C,19,41.56,s,
C,20,41.56,s,
C,21,78.37,s,
O,22,,,
C,23,100.5,s,
C,24,29.55,s,
C,25,30.57,s,
C,26,76.51,s,
O,27,,,
C,28,100.5,s,
C,29,29.55,s,
C,30,30.57,s,
C,31,70.48,s,
O,32,,,
C,33,71.02,s,
C,34,17.9,s,
O,35,,,
C,36,72.56,s,
C,37,17.64,s,
O,38,,,
C,39,72.56,s,
C,40,17.64,s,
O,41,,,
C,42,40.59,s,
C,43,74.62,s,
C,44,25.92,s,
O,45,,,
C,46,189.56,s,
O,47,,,
C,48,116.17,s,
C,49,161.6,s,
O,50,,,
C,51,124.23,s,
C,52,136.97,s,
C,53,119.26,s,
C,54,133.22,s,
C,55,181.0,s,
O,56,,,
H,57,3.62,s,
H,58,3.62,s,
H,59,3.62,s,
H,60,5.83,s,
H,61,7.61,s,
H,62,,,
H,63,5.64,dd,"8.9,1.0"
H,64,5.47,dd,"8.1,6.7"
H,65,2.16,ddd,"12.4,8.1,1.2"
H,66,2.16,ddd,"12.4,6.7,4.6"
H,67,3.41,ddd,"4.6,4.5,1.2"
H,68,2.84,s,
H,69,2.84,s,
H,70,2.84,s,
H,71,2.84,s,
H,72,2.84,s,
H,73,2.84,s,
H,74,4.91,dd,"7.5,4.5"
H,75,4.95,dd,"9.0,7.8"
H,76,1.75,m,
H,77,1.75,tdd,"12.4,9.0,2.0"
H,78,1.8,tdd,"12.4,12.1,1.4"
H,79,1.8,m,
H,80,4.61,ddd,"12.1,7.6,5.0"
H,81,4.95,dd,"8.4,2.5"
H,82,1.75,m,
H,83,1.75,m,
H,84,1.8,m,
H,85,1.8,m,
H,86,4.17,ddd,"8.6,1.0,0.6"
H,87,,,
H,88,3.63,qd,"6.1,0.6"
H,89,1.22,d,6.1
H,90,1.22,d,6.1
H,91,1.22,d,6.1
H,92,4.02,dq,"7.6,6.1"
H,93,1.21,d,6.1
H,94,1.21,d,6.1
H,95,1.21,d,6.1
H,96,3.91,dq,"7.5,6.1"
H,97,1.3,d,6.1
H,98,1.3,d,6.1
H,99,1.3,d,6.1
H,100,2.27,dd,"12.4,1.0"
H,101,2.27,dd,"12.4,8.9"
H,102,1.31,s,
H,103,1.31,s,
H,104,1.31,s,
H,105,,,
H,106,,,
H,107,7.32,dd,"8.0,1.4"
H,108,7.69,dd,"8.0,6.2"
H,109,7.78,dd,"6.2,1.4"
