BI2EY5 -OEChem-04012113003D 33 36 0 0 0 0 0 0 0999 V2000 -4.0050 0.2174 0.0114 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6947 -0.7815 -0.0215 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4646 1.1561 0.0096 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4825 -1.5220 -0.0185 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4494 -0.9257 -1.2648 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4395 -1.0505 1.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6795 -0.0214 -1.2341 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6694 -0.1483 1.2774 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5216 -0.2718 0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3693 -0.5109 -0.0133 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1113 0.8780 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3359 0.0926 0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8543 -1.1858 -0.0098 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5594 2.0847 0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6583 2.5125 0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4167 3.1129 0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9097 -2.1321 -0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1446 -1.5041 -0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8277 -0.6644 -2.1295 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7494 -1.9731 -1.3877 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7385 -2.1053 1.2268 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8106 -0.8764 2.0883 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 1.0293 -1.2548 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2866 -0.1921 -2.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2689 -0.4066 2.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3536 0.8951 1.3985 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9612 -1.2755 -0.0332 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3513 0.4426 0.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6315 2.2190 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 2.9489 0.0315 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2355 4.1785 0.0325 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7896 -3.2077 -0.0255 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1213 -1.9669 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 18 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 10 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 15 1 0 0 0 0 4 10 2 0 0 0 0 4 13 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 13 17 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 M END $$$$