B1KZ5T -OEChem-04042103263D 52 55 0 1 0 0 0 0 0999 V2000 4.9286 -2.3506 -0.8899 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.4860 -1.8189 -0.2823 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8939 -3.1552 -0.1534 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8878 -3.0051 -1.6699 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3216 -1.2818 0.3758 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1303 0.8167 0.4575 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1239 0.0458 0.9099 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4783 2.8649 -0.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6347 3.8881 -1.4479 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 2.9358 -0.9054 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5652 0.4118 0.7349 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8719 0.3821 2.2459 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9197 -0.9396 0.0911 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3154 -0.0561 2.5057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6331 -1.3749 1.8038 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7085 1.9198 -0.2231 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6744 1.8675 -0.2158 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9725 0.6910 0.4966 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3225 -1.5235 -0.5602 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2757 0.1577 0.8032 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3497 2.9001 -0.8578 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9686 -1.4120 -1.9892 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8929 -0.7278 -0.0804 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9206 0.5282 1.9835 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7155 3.8101 -1.3763 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1549 -1.2428 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1825 0.0130 2.2799 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7998 -0.8723 1.3961 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6199 -2.1684 -2.8751 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8575 -1.3036 -1.9873 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1766 1.1964 0.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7008 1.3730 2.6831 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1888 -0.3083 2.7569 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7037 -0.9166 -0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3018 -1.7441 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4848 -0.1567 3.5833 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 0.7233 2.1409 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6855 -1.6315 1.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0303 -2.1896 2.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2299 -0.6966 -2.3242 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -1.0064 -1.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4536 1.2182 2.6823 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2567 4.6169 -1.8589 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3142 2.2134 -0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2059 3.7046 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6852 0.3028 3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7855 -1.2559 1.6437 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3905 -2.0820 -3.9323 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3788 -2.8887 -2.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3659 -1.9407 -2.7141 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1699 -0.6288 -2.5006 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5915 -0.7421 -1.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 26 1 0 0 0 0 1 30 1 0 0 0 0 2 19 2 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 16 1 0 0 0 0 7 18 2 0 0 0 0 8 16 2 0 0 0 0 8 25 1 0 0 0 0 9 21 1 0 0 0 0 9 25 2 0 0 0 0 10 21 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 22 29 2 0 0 0 0 22 40 1 0 0 0 0 23 26 1 0 0 0 0 23 41 1 0 0 0 0 24 27 2 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END $$$$