MMs01238708 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3019 -0.7449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3078 -2.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0101 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3531 -1.2860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8942 0.7652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8883 2.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1844 3.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4864 2.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4922 0.7753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2019 -1.4798 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.7825 3.0303 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0844 2.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3806 3.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6825 2.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6883 0.7955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0903 0.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1786 4.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8767 5.2651 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5960 1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0416 0.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1078 -2.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3125 -3.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5078 -2.2403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8468 2.8611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5338 0.1793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7778 4.2303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0844 3.4854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6056 3.9567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1483 3.9627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0885 3.4247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8651 2.0917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8693 1.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1031 -0.3305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1671 -0.8758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6245 -0.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9077 0.9891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6842 -0.3438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4747 5.2752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 2 0 0 0 0 M CHG 1 22 -1 M END