MMs01284665 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 1.3002 -0.7480 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2610 -1.3480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3025 -2.2480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6027 -2.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 -2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8983 -0.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0040 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6373 0.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5957 1.5040 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8079 2.3876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3421 3.8135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8421 3.8111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3808 2.3838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 1.9181 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1613 2.9200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5872 2.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8967 0.9866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7034 3.4563 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3939 4.9240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1293 2.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2352 1.9263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5493 0.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9766 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0898 1.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7757 2.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3483 2.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5171 0.5424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6303 1.5478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5984 1.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0402 0.5984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5984 -1.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1204 -2.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8939 -3.3762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8328 -3.9164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3755 -3.9140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3128 -3.3709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0821 -2.0337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0804 -0.9505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3069 0.3843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2168 3.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7263 3.9787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2197 4.6763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1462 6.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 5.1716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5019 4.1312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 2.6179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7567 1.8498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6588 -0.3448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 -1.1751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6662 3.2748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 4.1051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4346 0.6573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5208 2.3522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8259 2.4383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END