C,1,19.3,s,
C,2,30.9,s,
C,3,19.3,s,
C,4,75.29,s,
O,5,,,
C,6,167.16,s,
O,7,,,
C,8,119.54,s,
C,9,145.83,s,
C,10,129.4,s,
C,11,141.0,s,
C,12,131.1,s,
C,13,134.35,s,
C,14,134.35,s,
C,15,134.35,s,
C,16,132.48,s,
C,17,131.72,s,
C,18,126.3,s,
C,19,132.39,s,
C,20,38.94,s,
C,21,68.29,s,
O,22,,,
C,23,43.24,s,
C,24,65.47,s,
O,25,,,
C,26,44.74,s,
C,27,69.09,s,
O,28,,,
C,29,45.17,s,
C,30,69.09,s,
O,31,,,
C,32,45.17,s,
C,33,69.09,s,
O,34,,,
C,35,45.17,s,
C,36,69.09,s,
O,37,,,
C,38,45.17,s,
C,39,69.09,s,
O,40,,,
C,41,45.17,s,
C,42,69.09,s,
O,43,,,
C,44,34.17,s,
C,45,68.5,s,
O,46,,,
C,47,34.88,s,
C,48,31.88,s,
C,49,38.08,s,
C,50,20.21,s,
H,51,1.02,d,6.4
H,52,1.02,d,6.4
H,53,1.02,d,6.4
H,54,1.86,m,"6.4,5.0"
H,55,1.02,d,6.4
H,56,1.02,d,6.4
H,57,1.02,d,6.4
H,58,4.07,dd,"8.3,5.0"
H,59,5.99,d,13.0
H,60,7.24,dd,"13.0,4.0"
H,61,6.56,dd,"13.0,4.0"
H,62,6.56,dd,"13.0,4.2"
H,63,6.56,dd,"13.0,4.2"
H,64,6.56,dd,"13.0,2.5"
H,65,6.56,dd,"13.0,2.5"
H,66,6.56,dd,"13.0,2.8"
H,67,6.56,dd,"13.0,2.8"
H,68,6.24,dd,"13.0,3.9"
H,69,6.41,dd,"12.0,3.9"
H,70,5.4,ddd,"12.0,11.1,3.0"
H,71,2.34,ddd,"15.4,9.8,3.0"
H,72,2.34,ddd,"15.4,11.1,5.6"
H,73,3.93,m,
H,74,,,
H,75,2.14,ddd,"12.4,9.4,8.1"
H,76,2.14,ddd,"12.4,7.8,1.5"
H,77,3.85,m,
H,78,,,
H,79,2.13,ddd,"12.4,10.3,1.6"
H,80,2.13,ddd,"12.4,10.5,1.0"
H,81,3.85,m,
H,82,,,
H,83,2.13,ddd,"12.4,11.2,0.8"
H,84,2.13,ddd,"12.4,5.4,3.4"
H,85,3.85,m,
H,86,,,
H,87,2.13,ddd,"12.4,11.2,2.6"
H,88,2.13,ddd,"12.4,11.7,2.9"
H,89,3.85,m,
H,90,,,
H,91,2.13,ddd,"12.4,4.6,1.8"
H,92,2.13,ddd,"12.4,11.1,8.6"
H,93,3.85,ddt,"10.3,8.6,1.8"
H,94,,,
H,95,2.13,ddd,"12.4,4.9,1.8"
H,96,2.13,ddd,"12.4,11.3,10.3"
H,97,3.85,m,
H,98,,,
H,99,2.13,ddd,"12.4,11.4,7.5"
H,100,2.13,ddd,"12.4,2.2,1.3"
H,101,3.85,m,
H,102,,,
H,103,1.6,ddd,"12.4,8.2,1.4"
H,104,1.6,ddd,"12.4,5.9,1.1"
H,105,3.73,m,
H,106,,,
H,107,1.43,dtd,"12.4,3.8,2.3"
H,108,1.43,m,
H,109,1.58,m,
H,110,1.58,m,
H,111,2.08,m,
H,112,1.0,d,6.5
H,113,1.0,d,6.5
H,114,1.0,d,6.5
