MMs03916353 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 69 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 0.7558 -1.2957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4883 -2.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2441 -1.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7099 -1.6276 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -3.1201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -3.7240 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8292 -0.6289 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1397 -1.7880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -0.9474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0508 0.3483 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.6508 1.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0521 1.4675 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0129 2.0675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6791 0.8636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3706 2.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2604 3.9420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5151 5.1147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5433 0.4984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4195 -0.7191 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -10.2957 -1.9366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6370 0.1571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.0045 -0.4591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2220 0.4171 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.2220 -0.7829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6465 -0.0528 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -15.8056 -0.3634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5336 1.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6574 2.3742 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.8089 3.2227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2287 1.9171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.1273 3.7987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2511 5.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1382 6.2257 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.5627 5.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5560 4.2558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8516 3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -19.1540 4.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.1608 5.7441 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -20.2027 6.3394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.8651 6.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8718 7.9999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -20.4497 3.4883 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.1036 -1.4815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.2762 -1.7362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7675 -3.8937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5953 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8966 -3.7247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -2.0869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3890 -1.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4812 2.4788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 3.9481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3290 -1.4509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8640 -1.2966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4218 0.3498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4290 1.9557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0511 5.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.4916 4.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.4443 2.2883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1722 -4.9356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9675 -3.8883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2020 -1.5953 0.0000 O 0 5 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 49 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 48 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 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 50 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 20 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 22 64 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 33 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 46 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 35 36 2 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 43 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 40 45 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 43 44 2 0 0 0 0 45 60 1 0 0 0 0 45 61 1 0 0 0 0 46 47 1 0 0 0 0 48 62 1 0 0 0 0 48 63 1 0 0 0 0 M CHG 1 64 -1 M END