MMs00701781 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 68 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 1.2883 0.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5978 0.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3293 1.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8663 -1.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9073 -0.6947 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4831 -1.1190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9286 -2.1946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2381 -2.9261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5264 -2.1578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5052 -0.6580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 -0.1743 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8238 -1.3752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9594 -2.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4431 -4.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4553 -5.1498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9146 -4.3120 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3237 -1.3540 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0552 -0.0444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2869 1.2439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5550 -0.0232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3234 -1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8232 -1.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5547 0.0193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.7864 1.3076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2866 1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5183 2.5746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2498 3.8841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7496 3.9054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5180 2.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5915 -2.5785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0009 -3.9574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1297 -4.9452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4180 -4.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0854 -2.7142 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.7968 -4.7675 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1956 0.0736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6147 1.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0306 -0.6147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3073 -0.5153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 1.6766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6674 1.2334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8532 1.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9146 2.3939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8055 1.6389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3425 -0.9801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2811 -2.3204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3901 -1.5654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3363 -2.0988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5342 -3.3279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4799 -3.8562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0224 -3.8344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3015 -5.4479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7048 -3.4090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 -2.3846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7381 -2.3591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3184 2.5576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6351 4.9148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3349 4.9530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7178 2.6341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8308 -4.2234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0212 -6.1402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8035 0.5277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9539 1.0037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 46 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 37 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 51 1 0 0 0 0 9 52 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 2 0 0 0 0 23 31 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 34 2 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 37 63 1 0 0 0 0 37 64 1 0 0 0 0 M END