MMs03358954 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 1.3168 -0.7184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -0.0754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 1.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7023 -1.1655 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9839 -2.4823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5096 -2.2060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6269 -3.8375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -3.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9741 -2.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4693 -2.8445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2504 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7097 -3.7778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8304 -2.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4458 -1.7058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1110 -1.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4277 -2.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7083 -1.4387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6720 0.0608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3553 0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0747 -0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9526 0.8420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9164 2.3415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2694 0.1236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5499 0.9047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7651 -5.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9129 -6.5479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5747 1.0534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0534 0.5747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5747 -1.0534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4597 -1.6396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 -5.2327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6206 -4.5590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4567 -3.4196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7617 -2.0135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3263 1.9789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0213 0.5728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1748 -0.1197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5743 1.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9250 1.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2602 -5.4341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7746 -6.5183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 41 42 1 0 0 0 0 M END