MMs02236593 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 -0.7472 -1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0056 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5055 -2.5949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2528 -1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7207 -1.6030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8806 -3.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5116 -3.7074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2646 -4.8817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8332 -0.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2608 -1.0574 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3000 -1.6574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3734 -0.0513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0584 1.4153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8009 -0.5118 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9135 0.4943 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2241 -0.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5985 1.9609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7111 2.9669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3961 4.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5086 5.4396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9362 4.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2512 3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1386 2.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0488 5.9852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7968 7.1584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3411 0.0338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4537 1.0399 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5957 0.6715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3276 1.6265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6561 -1.4327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6022 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9472 -1.3032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5922 -3.6386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0978 1.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9211 -3.6922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 0.1399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3943 0.4639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0529 -1.6850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4868 1.5090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9604 2.9772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2540 4.8019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2566 6.6128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3933 3.1442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2646 1.9199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5758 -2.5239 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4026 -2.7759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8278 -3.6971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7490 -2.2719 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 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 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 47 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 28 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 28 32 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M CHG 1 47 1 M END