D05PTG 05220901212D 1 1.00000 0.00000 0 53 54 0 1 0 999 V2000 7.6271 0.1998 0.0000 N 0 0 0 0 0 0 0 0 0 8.2393 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 8.2365 1.2687 0.0000 N 0 0 0 0 0 0 0 0 0 7.6253 1.6195 0.0000 C 0 0 0 0 0 0 0 0 0 6.3430 1.4842 0.0000 N 0 0 0 0 0 0 0 0 0 5.9242 0.9132 0.0000 C 0 0 0 0 0 0 0 0 0 6.3379 0.3385 0.0000 N 0 0 3 0 0 0 0 0 0 7.0123 0.5544 0.0000 C 0 0 0 0 0 0 0 0 0 7.0154 1.2624 0.0000 C 0 0 0 0 0 0 0 0 0 3.7023 0.5764 0.0000 O 0 0 0 0 0 0 0 0 0 2.9898 0.5764 0.0000 O 0 5 0 0 0 0 0 0 0 3.3440 -0.0397 0.0000 P 0 0 3 0 0 0 0 0 0 6.1250 -1.0709 0.0000 C 0 0 1 0 0 0 0 0 0 5.4125 -1.0709 0.0000 C 0 0 1 0 0 0 0 0 0 5.1932 -0.3951 0.0000 C 0 0 2 0 0 0 0 0 0 5.7709 0.0292 0.0000 O 0 0 0 0 0 0 0 0 0 6.3484 -0.3951 0.0000 C 0 0 1 0 0 0 0 0 0 4.5792 -0.0417 0.0000 C 0 0 0 0 0 0 0 0 0 3.9610 -0.3949 0.0000 O 0 0 0 0 0 0 0 0 0 2.7300 -0.3930 0.0000 O 0 0 0 0 0 0 0 0 0 2.1129 -0.0378 0.0000 C 0 0 0 0 0 0 0 0 0 1.4948 -0.3910 0.0000 C 0 0 3 0 0 0 0 0 0 0.8777 -0.0359 0.0000 C 0 0 0 0 0 0 0 0 0 1.4937 -1.1035 0.0000 O 0 0 0 0 0 0 0 0 0 0.2596 -0.3891 0.0000 O 0 0 0 0 0 0 0 0 0 -0.3575 -0.0340 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9756 -0.3872 0.0000 C 0 0 0 0 0 0 0 0 0 4.9966 -1.6484 0.0000 O 0 0 0 0 0 0 0 0 0 0.8755 -1.4609 0.0000 C 0 0 0 0 0 0 0 0 0 0.2585 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3597 -1.4590 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9767 -1.0997 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5907 -1.4571 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2078 -1.0978 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8259 -1.4551 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5885 -0.0321 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2067 -0.3853 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8237 -0.0301 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8226 0.6824 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2044 1.0397 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5874 0.6804 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9734 1.0378 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3564 0.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0.2618 1.0359 0.0000 C 0 0 0 0 0 0 0 0 0 0.8788 0.6766 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8270 -2.1676 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2100 -2.5228 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5918 -2.1696 0.0000 C 0 0 0 0 0 0 0 0 0 6.9583 -0.7458 0.0000 H 0 0 0 0 0 0 0 0 0 7.6222 2.3278 0.0000 N 0 0 0 0 0 0 0 0 0 8.8538 0.2025 0.0000 Cl 0 0 0 0 0 0 0 0 0 6.5399 -1.6450 0.0000 F 0 0 0 0 0 0 0 0 0 3.1458 1.3125 0.0000 Na 0 3 0 0 0 0 0 0 0 13 14 1 0 0 0 25 26 1 0 0 0 8 1 1 0 0 0 26 27 1 0 0 0 6 7 1 0 0 0 14 28 1 6 0 0 2 3 1 0 0 0 24 29 1 0 0 0 29 30 1 0 0 0 3 4 2 0 0 0 30 31 1 0 0 0 14 15 1 0 0 0 31 32 1 0 0 0 15 16 1 0 0 0 32 33 1 0 0 0 16 17 1 0 0 0 33 34 1 0 0 0 17 13 1 0 0 0 34 35 1 0 0 0 5 6 2 0 0 0 27 36 1 0 0 0 15 18 1 1 0 0 36 37 1 0 0 0 7 8 1 0 0 0 37 38 1 0 0 0 18 19 1 0 0 0 38 39 1 0 0 0 19 12 1 0 0 0 39 40 1 0 0 0 9 5 1 0 0 0 40 41 1 0 0 0 12 20 1 0 0 0 41 42 1 0 0 0 12 11 1 0 0 0 42 43 1 0 0 0 20 21 1 0 0 0 43 44 1 0 0 0 10 12 2 0 0 0 44 45 1 0 0 0 21 22 1 0 0 0 35 46 1 0 0 0 4 9 1 0 0 0 46 47 1 0 0 0 22 23 1 0 0 0 47 48 1 0 0 0 7 17 1 0 0 0 8 9 2 0 0 0 17 49 1 6 0 0 22 24 1 0 0 0 4 50 1 0 0 0 1 2 2 0 0 0 2 51 1 0 0 0 23 25 1 0 0 0 13 52 1 1 0 0 M CHG 2 11 -1 53 1 M END $$$$