B1NYH2 -OEChem-04022109263D 37 38 0 0 0 0 0 0 0999 V2000 2.2032 -1.9162 -0.0090 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2147 -1.5634 -0.0045 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8988 -1.2818 0.0103 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8809 -1.1726 0.0185 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2670 1.0155 -0.0242 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1778 0.9553 0.0024 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3759 0.3808 -0.0014 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2011 -0.5132 -0.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7676 0.8395 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0106 0.6268 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2005 -0.4273 -0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5351 0.4593 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0021 1.9892 0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3928 1.8965 0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1849 -0.0332 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5894 -0.9143 -0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1117 -0.0729 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6769 -0.3467 0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5464 -0.6803 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5049 0.9300 0.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9665 -0.1710 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7509 -1.3546 -0.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6706 1.0880 0.8913 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6715 1.0942 -0.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4645 2.9729 0.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9963 2.7998 0.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5348 1.9085 0.0037 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9294 0.5532 0.8914 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9323 0.5584 -0.8849 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9422 -0.9390 0.8876 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9443 -0.9379 -0.8809 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4112 -1.3059 0.8894 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4104 -1.3032 -0.8919 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2922 1.5347 0.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5726 0.6891 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2944 1.5354 -0.8826 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8000 -0.8296 0.0136 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 16 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 17 2 0 0 0 0 4 21 1 0 0 0 0 4 37 1 0 0 0 0 5 21 2 0 0 0 0 6 9 1 0 0 0 0 6 17 1 0 0 0 0 6 27 1 0 0 0 0 7 10 1 0 0 0 0 7 16 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 11 22 1 0 0 0 0 12 17 1 0 0 0 0 12 19 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 18 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 18 20 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 21 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 M END $$$$