MMs01713633 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4311 -0.4493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -1.8712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4088 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8581 -0.4251 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6358 0.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3607 1.9190 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3214 1.3190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 2.4460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0108 3.9257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4151 4.4528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5737 3.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9781 4.0271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 2.0203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9236 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6779 0.0136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4866 1.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6609 5.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8522 4.8784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4478 4.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 2.8717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2979 2.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0608 4.1482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 1.5503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5348 1.5354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2892 5.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3594 1.1449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1449 0.3594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3594 -1.1449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2132 -2.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1237 -2.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7244 0.1407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4135 0.3055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2488 1.9945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8447 5.7359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8575 7.1163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4771 6.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0488 6.0622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5468 2.7353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7348 1.5234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5229 0.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0514 6.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6377 6.0662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 4.3772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 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 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END