L8O4JS -OEChem-05022322003D 28 27 0 1 0 0 0 0 0999 V2000 1.0850 1.3411 -0.1772 S 0 0 2 0 0 0 0 0 0 0 0 0 2.8116 -0.9074 0.0766 P 0 0 0 0 0 0 0 0 0 0 0 0 0.9741 1.5619 -1.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0253 -0.8770 -1.6874 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9951 -1.3904 1.0699 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6401 -1.9855 0.3732 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0298 -1.9694 0.3013 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2247 -0.8510 -1.3672 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2765 0.6517 0.5286 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 0.2651 1.7322 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3702 0.4782 0.3275 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6306 1.2104 -0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9085 0.4640 0.2854 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8718 2.9296 0.5984 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9846 -0.9212 -0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3264 -0.5102 -0.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3219 0.3631 1.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6193 1.3466 -1.2082 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6714 2.2134 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7977 1.0279 -0.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8167 3.4730 0.5169 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0979 3.4935 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6145 2.7885 1.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8214 -0.1448 2.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8757 1.1678 2.2028 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0849 -1.7738 -2.0803 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4941 -2.2059 0.8505 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7424 -2.9008 0.0358 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 9 2 0 0 0 0 1 11 1 0 0 0 0 1 14 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 8 2 0 0 0 0 2 9 1 0 0 0 0 4 15 1 0 0 0 0 4 26 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 15 2 0 0 0 0 10 13 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 M END $$$$