C,1,17.8,s,
C,2,129.35,s,
C,3,129.1,s,
C,4,76.0,s,
O,5,,,
C,6,41.6,s,
C,7,18.77,s,
C,8,18.77,s,
C,9,78.5,s,
C,10,28.6,s,
C,11,129.97,s,
C,12,133.32,s,
C,13,53.76,s,
O,14,,,
C,15,53.76,s,
C,16,133.32,s,
C,17,130.27,s,
C,18,132.45,s,
C,19,118.64,s,
C,20,161.5,s,
N,21,,,
C,22,133.4,s,
C,23,143.2,s,
O,24,,,
C,25,161.1,s,
O,26,,,
O,27,,,
C,28,78.5,s,
C,29,41.6,s,
C,30,18.77,s,
C,31,18.77,s,
C,32,76.0,s,
O,33,,,
C,34,129.1,s,
C,35,129.35,s,
C,36,17.8,s,
C,37,28.6,s,
C,38,129.97,s,
C,39,133.32,s,
C,40,53.76,s,
O,41,,,
C,42,53.76,s,
C,43,117.2,s,
C,44,133.32,s,
C,45,78.8,s,
O,46,,,
C,47,56.4,s,
C,48,34.9,s,
C,49,162.2,s,
N,50,,,
C,51,132.9,s,
C,52,144.1,s,
O,53,,,
C,54,161.3,s,
O,55,,,
O,56,,,
H,57,1.64,d,7.0
H,58,1.64,d,7.0
H,59,1.64,d,7.0
H,60,5.4,dq,"11.0,7.0"
H,61,5.4,dd,"11.0,7.0"
H,62,3.79,d,7.0
H,63,,,
H,64,0.89,s,
H,65,0.89,s,
H,66,0.89,s,
H,67,0.89,s,
H,68,0.89,s,
H,69,0.89,s,
H,70,5.18,dd,"10.7,2.4"
H,71,2.53,ddd,"15.4,3.0,2.4"
H,72,2.53,ddd,"15.4,11.6,10.7"
H,73,5.7,dd,"11.6,3.0"
H,74,6.14,d,9.7
H,75,4.57,dd,"9.7,8.8"
H,76,4.57,dd,"8.9,8.8"
H,77,6.14,d,8.9
H,78,6.99,d,4.6
H,79,6.57,d,4.6
H,80,6.13,s,
H,81,7.99,s,
H,82,5.18,dd,"5.8,2.9"
H,83,0.89,s,
H,84,0.89,s,
H,85,0.89,s,
H,86,0.89,s,
H,87,0.89,s,
H,88,0.89,s,
H,89,3.79,d,7.0
H,90,,,
H,91,5.4,dd,"15.0,7.0"
H,92,5.4,dq,"15.0,7.0"
H,93,1.64,d,7.0
H,94,1.64,d,7.0
H,95,1.64,d,7.0
H,96,2.53,ddd,"15.4,2.9,2.7"
H,97,2.53,ddd,"15.4,9.3,5.8"
H,98,5.7,dd,"9.3,2.7"
H,99,6.14,d,3.0
H,100,4.57,dd,"7.4,3.0"
H,101,4.57,dd,"10.7,7.4"
H,102,6.14,d,10.7
H,103,6.14,d,4.2
H,104,3.97,ddd,"12.3,4.2,3.5"
H,105,3.15,s,
H,106,3.15,s,
H,107,3.15,s,
H,108,2.95,dd,"15.4,3.5"
H,109,2.95,dd,"15.4,12.3"
H,110,8.1,s,
