MMs01880694 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 -0.7450 -1.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -1.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 1.2904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 1.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 1.2789 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8550 2.3181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 2.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 2.5865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7549 1.2731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7450 -1.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7449 -1.3365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2449 -1.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 -0.0461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9899 -2.6442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2349 -3.9403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9799 -5.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2250 -6.5384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4799 -5.2480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2349 -3.9519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4899 -2.6499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2449 -1.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7449 -1.3596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4899 -2.6615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7349 -3.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -2.3492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 1.8088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 2.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -1.1983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -0.4321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3589 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7961 1.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1291 0.3715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1409 -2.3734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3187 -3.1655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3127 -4.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0759 -6.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6489 -0.3123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3489 -0.3226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6899 -2.6661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3309 -4.9991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2649 3.8769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6689 4.9184 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 48 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 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 25 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 48 49 1 0 0 0 0 M END