DI1201001 Mrv1827 08212009582D 33 37 0 0 0 0 999 V2000 -7.1050 -0.8509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8401 -1.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8833 -2.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1913 -2.4986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4562 -2.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4131 -1.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6861 -2.4197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6162 -1.0867 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1669 -1.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0618 -0.0270 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.5320 -0.7761 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.6184 -2.4238 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 -1.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3267 0.3475 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.7537 0.4223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4726 -3.2166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6757 -3.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4621 -4.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6653 -4.4405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0819 -3.8572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2954 -3.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0923 -2.8468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -4.0707 0.0000 B 0 0 0 0 0 0 0 0 0 0 0 0 -2.3282 -3.2469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7343 -4.7626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -2.9512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2151 -5.4037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4287 -6.2006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3445 -2.1543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0388 -3.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4449 -5.1081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4881 -4.2843 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6912 -4.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 1 6 1 0 0 0 0 6 8 1 0 0 0 0 5 6 2 0 0 0 0 7 5 1 0 0 0 0 8 9 2 0 0 0 0 7 9 1 0 0 0 0 1 10 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 2 0 0 0 0 7 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 26 29 2 0 0 0 0 26 30 1 0 0 0 0 27 31 1 0 0 0 0 30 32 1 0 0 0 0 32 31 1 0 0 0 0 32 33 1 0 0 0 0 32 23 8 0 0 0 0 M CHG 2 10 1 14 -1 M STY 1 1 DAT M SAL 1 2 32 23 M SDT 1 MRV_COORDINATE_BOND_TYPE M SDD 1 0.0000 0.0000 DR ALL 0 0 M SED 1 37 M END > (DI1201001) DI1201001 $$$$ DI1201002 Mrv1827 08212009582D 28 30 0 0 0 0 999 V2000 -17.2808 8.4047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9952 7.9922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9952 7.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2808 6.7547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.5663 7.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5663 7.9922 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.8518 6.7547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -17.2808 9.2297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.7097 6.7547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -19.4242 7.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.1387 6.7547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.8531 7.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.8531 7.9922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.5676 8.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.2821 7.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.2821 7.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.5676 6.7548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.9965 8.4048 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -23.4090 7.6903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -22.5840 9.1193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -23.7110 8.8173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.5663 9.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5663 10.4672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2808 10.8797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9953 10.4672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9953 9.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8519 10.8797 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -15.8519 9.2297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 1 6 2 0 0 0 0 5 7 1 0 0 0 0 1 8 1 0 0 0 0 3 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 8 22 1 0 0 0 0 8 26 2 0 0 0 0 23 27 1 0 0 0 0 22 28 1 0 0 0 0 M END > (DI1201002) DI1201002 $$$$ DI1201003 Mrv1827 08212009582D 27 30 0 0 0 0 999 V2000 -3.1135 0.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3991 -0.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3991 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1135 -1.4732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -0.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6145 -1.3156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1296 -0.6482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6144 0.0192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3046 -0.6482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3595 0.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9115 1.4169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6565 2.2016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8495 2.3731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2975 1.7600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5525 0.9753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5946 3.1577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2124 3.3292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1466 3.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5425 -1.4732 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7644 2.7161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5714 2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1234 2.2744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8684 1.4898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0614 1.3183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5094 1.9315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4204 0.8767 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 2 9 1 0 0 0 0 3 7 1 0 0 0 0 8 10 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 9 11 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 5 20 1 0 0 0 0 18 21 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 24 27 1 0 0 0 0 M END > (DI1201003) DI1201003 $$$$ DI1201004 Mrv1827 08212009582D 33 37 0 0 0 0 999 V2000 1.2546 2.6225 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9691 2.2100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9691 1.3850 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2546 0.9725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5402 1.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5402 2.2100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2445 1.1300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7294 1.7975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2445 2.4649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2546 3.4475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6836 2.6225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6836 0.9725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2546 0.1475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4994 0.3454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0526 -0.2677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8731 -0.1815 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2087 -0.9351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5956 -1.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1189 -1.0747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6818 -2.3076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4355 -2.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5217 -3.4637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8543 -3.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1006 -3.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0144 -2.7926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5668 -4.0980 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.5544 1.7975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9405 -4.7691 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.9669 1.0830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7919 1.0830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2044 1.7975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7919 2.5119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9669 2.5119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 1 6 1 0 0 0 0 5 7 1 0 0 0 0 6 5 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 1 10 1 0 0 0 0 2 11 2 0 0 0 0 3 12 1 0 0 0 0 4 13 2 0 0 0 0 7 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 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 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 8 27 1 0 0 0 0 23 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 M END > (DI1201004) DI1201004 $$$$ DI1201005 Mrv1827 08212009582D 27 30 0 0 0 0 999 V2000 -8.8244 -12.3249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1099 -11.9124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1099 -11.0874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8244 -10.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5389 -11.0874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5389 -11.9124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3254 -10.8325 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8404 -11.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3253 -12.1673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0154 -11.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0704 -10.0479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2635 -9.8763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0085 -9.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5606 -8.4786 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3675 -8.6501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6225 -9.4348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8244 -13.1499 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.3057 -7.6940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8577 -7.0809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4987 -7.5225 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9467 -8.1355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1397 -7.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5876 -8.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8425 -9.3617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6495 -9.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2016 -8.9202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2905 -9.9748 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 2 9 1 0 0 0 0 3 7 1 0 0 0 0 8 10 2 0 0 0 0 7 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 1 17 1 0 0 0 0 14 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 24 27 1 0 0 0 0 M END > (DI1201005) DI1201005 $$$$ DI1201006 Mrv1827 08212009582D 36 40 0 0 0 0 999 V2000 2.1646 1.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4501 1.4277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7357 1.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7357 0.1902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4501 -0.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1646 0.1902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0489 -0.0648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5339 0.6026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 1.2701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3589 0.6026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3039 2.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2481 2.6678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0069 3.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8139 3.6239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3659 3.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1109 2.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4501 -1.0473 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0688 4.4086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8758 4.5801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5168 5.0217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4592 3.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 4.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8394 3.6268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6259 2.8299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 2.6164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2456 3.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2093 2.2466 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 0.7827 -1.5323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0377 -2.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8627 -2.3168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1176 -1.5323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5527 -2.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8883 -3.7380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2677 -2.8981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6802 -2.1836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5052 -2.1836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 3 9 1 0 0 0 0 4 7 1 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 5 17 1 0 0 0 0 14 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 24 27 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 17 28 1 0 0 0 0 17 31 1 0 0 0 0 29 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 M END > (DI1201006) DI1201006 $$$$ DI1201007 Mrv1827 08212009582D 31 34 0 0 0 0 999 V2000 -1.8750 -0.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5895 -0.7482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5895 -1.5732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -1.9857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1605 -1.5732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1605 -0.7482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -1.8281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -1.1607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3741 -0.4933 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -1.1607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6291 0.2913 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0771 0.9044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 1.6891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 1.8606 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6910 1.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 0.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 2.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2009 2.8167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 3.2583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 2.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5599 2.3751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1120 1.7619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8570 0.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 0.8058 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 1.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9189 1.9334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4090 0.3642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -2.8107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1605 -3.2232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5895 -3.2232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1541 -0.4204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 2 9 1 0 0 0 0 3 7 1 0 0 0 0 8 10 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 9 1 1 0 0 0 14 17 1 1 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 22 26 1 0 0 0 0 23 27 1 0 0 0 0 4 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 27 31 1 0 0 0 0 M END > (DI1201007) DI1201007 $$$$