C,1,9.8,s,
C,2,27.7,s,
C,3,83.52,s,
O,4,,,
C,5,173.45,s,
O,6,,,
C,7,43.28,s,
C,8,12.66,s,
C,9,75.65,s,
O,10,,,
C,11,100.5,s,
C,12,45.3,s,
C,13,80.53,s,
C,14,23.64,s,
O,15,,,
C,16,51.75,s,
C,17,74.89,s,
O,18,,,
C,19,72.56,s,
C,20,17.64,s,
O,21,,,
C,22,37.71,s,
C,23,12.57,s,
C,24,76.57,s,
O,25,,,
C,26,102.46,s,
O,27,,,
C,28,72.7,s,
C,29,20.86,s,
C,30,36.08,s,
C,31,58.37,s,
N,32,,,
C,33,31.3,s,
C,34,73.63,s,
O,35,,,
C,36,73.7,s,
C,37,24.74,s,
O,38,,,
C,39,37.71,s,
C,40,43.68,s,
C,41,15.6,s,
C,42,,,
O,43,,,
C,44,48.25,s,
C,45,12.02,s,
C,46,74.88,s,
O,47,,,
C,48,77.48,s,
C,49,25.81,s,
O,50,,,
H,51,0.84,t,7.0
H,52,0.84,t,7.0
H,53,0.84,t,7.0
H,54,1.67,qd,"7.0,5.8"
H,55,1.67,qd,"7.0,5.8"
H,56,5.16,t,5.8
H,57,2.82,qd,"6.7,2.8"
H,58,1.21,d,6.7
H,59,1.21,d,6.7
H,60,1.21,d,6.7
H,61,4.8,dd,"5.5,2.8"
H,62,4.95,dd,"8.4,6.6"
H,63,2.38,dd,"12.4,8.4"
H,64,2.38,dd,"12.4,6.6"
H,65,1.46,s,
H,66,1.46,s,
H,67,1.46,s,
H,68,3.31,s,
H,69,3.31,s,
H,70,3.31,s,
H,71,4.12,d,4.8
H,72,,,
H,73,3.91,qd,"6.1,4.8"
H,74,1.3,d,6.1
H,75,1.3,d,6.1
H,76,1.3,d,6.1
H,77,2.17,dqd,"8.0,6.6,5.5"
H,78,1.08,d,6.6
H,79,1.08,d,6.6
H,80,1.08,d,6.6
H,81,5.19,d,8.0
H,82,4.28,d,4.4
H,83,4.53,dqd,"9.5,6.0,5.4"
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,"12.4,12.2,5.4"
H,88,2.2,ddd,"12.4,9.5,3.2"
H,89,3.7,ddd,"12.2,10.0,3.2"
H,90,,,
H,91,2.94,s,
H,92,2.94,s,
H,93,2.94,s,
H,94,3.93,dd,"10.0,4.4"
H,95,,,
H,96,1.26,s,
H,97,1.26,s,
H,98,1.26,s,
H,99,,,
H,100,1.55,dd,"12.4,6.7"
H,101,1.55,dd,"12.4,5.0"
H,102,2.9,dqd,"6.7,6.6,5.0"
H,103,1.12,d,6.6
H,104,1.12,d,6.6
H,105,1.12,d,6.6
H,106,3.03,dq,"9.4,6.7"
H,107,1.13,d,6.7
H,108,1.13,d,6.7
H,109,1.13,d,6.7
H,110,3.82,d,9.4
H,111,,,
H,112,1.4,s,
H,113,1.4,s,
H,114,1.4,s,
H,115,,,
