D03PVV -OEChem-10191521302D 83 82 0 1 0 0 0 0 0999 V2000 6.3301 -0.4050 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 5.4641 -0.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 0.4610 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8301 -1.2710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4050 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 17.5885 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4545 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3205 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1865 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0526 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9186 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7846 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6506 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5167 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.0950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7942 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9870 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1899 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0560 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8530 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3239 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1210 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7190 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9220 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2549 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4579 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7880 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5851 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5919 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3889 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4511 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6540 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5201 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3171 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5229 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7258 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8291 -0.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -1.8080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -1.5810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 0.1510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 0.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 0.7710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1831 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3861 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8598 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6569 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 0.0699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 0.0699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2521 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0492 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7908 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9938 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.8267 -0.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.0536 0.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2067 0.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 1 7 2 0 0 0 0 2 26 1 0 0 0 0 3 30 1 0 0 0 0 3 32 1 0 0 0 0 4 33 1 0 0 0 0 5 30 2 0 0 0 0 31 8 1 1 0 0 0 8 83 1 0 0 0 0 9 18 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 15 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 16 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 17 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 20 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 19 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 26 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 24 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 25 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 24 27 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 25 28 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 27 29 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 28 30 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 75 1 0 0 0 0 29 76 1 0 0 0 0 29 77 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 33 81 1 0 0 0 0 33 82 1 0 0 0 0 M CHG 2 6 -1 9 1 M END $$$$