BKE3N6 -OEChem-04022105413D 28 29 0 1 0 0 0 0 0999 V2000 3.3242 1.1906 1.4269 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5068 -0.2775 -0.1813 N 0 0 1 0 0 0 0 0 0 0 0 0 1.2851 0.4830 0.6877 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -1.3748 -0.9038 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4968 -0.9304 -1.4022 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3513 -0.5305 -0.2196 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8872 -0.2157 -0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6603 0.4673 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6541 0.8642 -0.4902 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5649 -1.2468 0.6815 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0354 0.9101 -0.3019 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9883 1.9834 -1.2225 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9462 -1.2007 0.8698 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6815 -0.1222 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5168 -1.6619 -1.7645 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.2534 -0.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3844 -0.0791 -2.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9797 -1.7394 -1.9606 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2893 -0.0901 -0.5748 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5983 -1.4084 0.3885 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7701 1.1149 1.2928 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0097 -2.0946 1.0771 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6231 1.7437 -0.6773 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3951 2.5918 -0.5323 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3394 1.5993 -2.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7189 2.6436 -1.7028 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4493 -2.0038 1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 -0.0862 0.5253 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 3 8 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 10 22 1 0 0 0 0 11 14 1 0 0 0 0 11 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 M END $$$$