C,1,9.8,s,
C,2,27.7,s,
C,3,83.52,s,
O,4,,,
C,5,172.96,s,
O,6,,,
C,7,54.4,s,
C,8,70.43,s,
O,9,,,
C,10,115.28,s,
C,11,30.5,s,
C,12,80.53,s,
C,13,23.64,s,
O,14,,,
C,15,51.75,s,
C,16,74.89,s,
O,17,,,
C,18,72.56,s,
C,19,17.64,s,
O,20,,,
O,21,,,
C,22,75.65,s,
C,23,38.31,s,
C,24,12.71,s,
C,25,76.57,s,
O,26,,,
C,27,102.46,s,
O,28,,,
C,29,72.7,s,
C,30,20.86,s,
C,31,36.08,s,
C,32,63.83,s,
N,33,,,
C,34,41.56,s,
C,35,41.56,s,
C,36,73.63,s,
O,37,,,
C,38,73.7,s,
C,39,24.74,s,
O,40,,,
C,41,37.71,s,
C,42,43.68,s,
C,43,15.6,s,
C,44,,,
O,45,,,
C,46,48.25,s,
C,47,12.02,s,
C,48,74.88,s,
O,49,,,
C,50,77.48,s,
C,51,25.81,s,
O,52,,,
H,53,0.84,t,7.0
H,54,0.84,t,7.0
H,55,0.84,t,7.0
H,56,1.67,qd,"7.0,5.8"
H,57,1.67,qd,"7.0,5.8"
H,58,5.16,t,5.8
H,59,2.83,ddd,"11.4,8.9,2.3"
H,60,4.04,dd,"11.4,9.4"
H,61,4.04,dd,"9.4,2.3"
H,62,2.05,s,
H,63,2.05,s,
H,64,1.46,s,
H,65,1.46,s,
H,66,1.46,s,
H,67,3.31,s,
H,68,3.31,s,
H,69,3.31,s,
H,70,4.12,d,7.2
H,71,,,
H,72,3.91,dq,"7.2,6.1"
H,73,1.3,d,6.1
H,74,1.3,d,6.1
H,75,1.3,d,6.1
H,76,4.8,dd,"11.0,8.9"
H,77,1.8,dqd,"11.0,6.6,4.8"
H,78,0.88,d,6.6
H,79,0.88,d,6.6
H,80,0.88,d,6.6
H,81,5.19,d,4.8
H,82,4.28,d,4.3
H,83,4.53,ddq,"9.6,6.1,6.0"
H,84,1.29,d,6.0
H,85,1.29,d,6.0
H,86,1.29,d,6.0
H,87,2.2,ddd,"12.5,12.4,6.1"
H,88,2.2,ddd,"12.4,9.6,3.7"
H,89,3.41,ddd,"12.5,3.7,1.6"
H,90,2.84,s,
H,91,2.84,s,
H,92,2.84,s,
H,93,2.84,s,
H,94,2.84,s,
H,95,2.84,s,
H,96,3.93,dd,"4.3,1.6"
H,97,,,
H,98,1.26,s,
H,99,1.26,s,
H,100,1.26,s,
H,101,,,
H,102,1.55,dd,"12.4,4.0"
H,103,1.55,dd,"12.4,4.5"
H,104,2.9,qdd,"6.6,4.5,4.0"
H,105,1.12,d,6.6
H,106,1.12,d,6.6
H,107,1.12,d,6.6
H,108,3.03,qd,"6.7,1.6"
H,109,1.13,d,6.7
H,110,1.13,d,6.7
H,111,1.13,d,6.7
H,112,3.82,d,1.6
H,113,,,
H,114,1.19,s,
H,115,1.19,s,
H,116,1.19,s,
H,117,,,
