MMs03916266 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 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 1.4999 0.0130 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2612 -1.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5225 -2.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0226 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7387 -1.3055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4286 -4.0285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7926 -4.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9984 -4.0075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8511 -4.5044 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8511 -3.3044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3022 -5.9350 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6128 -7.0941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8021 -5.9480 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0021 -5.9480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -4.5255 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5886 -3.3664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0722 -3.6333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7086 -4.0744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8146 -5.0877 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2451 -4.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3511 -5.6499 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.1996 -6.4984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7816 -5.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8876 -6.2121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6733 -7.1691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1757 -8.2611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -7.1408 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7611 -1.2664 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -6.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1544 -3.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6606 -3.3438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6910 -3.5722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1971 -3.9060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3701 -2.3004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3521 -0.2220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1062 -3.7343 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -9.0265 -7.1144 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.1981 -7.3740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7668 -8.2859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8549 -6.8547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 39 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 26 27 1 0 0 0 0 29 36 1 0 0 0 0 29 37 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 38 -1 M CHG 1 39 1 M END