B2D1ZC -OEChem-04022107362D 47 49 0 0 0 0 0 0 0999 V2000 4.0981 1.4654 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8450 3.5789 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.0734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6694 1.9609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9495 4.5734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7405 2.5844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8505 3.6834 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 1.4654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6859 2.2744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 0.5144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 2.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2682 2.9789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 0.5144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2791 3.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8614 3.8925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.0734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8669 3.9970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2627 2.8744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8395 3.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 0.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9326 1.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1994 0.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.2634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 3.2528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.2634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2259 4.3941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6147 4.5634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.8834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5983 4.2498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7747 2.8578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4561 3.4096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9043 4.0910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.2634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.1104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -5.1104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.8834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -4.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 16 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 8 1 0 0 0 0 2 26 1 0 0 0 0 3 20 1 0 0 0 0 3 27 1 0 0 0 0 4 22 1 0 0 0 0 4 28 1 0 0 0 0 5 25 2 0 0 0 0 8 25 1 0 0 0 0 8 38 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 14 2 0 0 0 0 11 18 1 0 0 0 0 12 17 2 0 0 0 0 12 19 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 21 2 0 0 0 0 15 25 1 0 0 0 0 16 31 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 18 23 2 0 0 0 0 18 33 1 0 0 0 0 19 24 2 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 21 23 1 0 0 0 0 21 35 1 0 0 0 0 22 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END $$$$