RDKit 3D 95 97 0 0 0 0 0 0 0 0999 V2000 15.2804 -0.1777 -0.7627 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2990 -1.6805 -0.8888 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2626 -2.3541 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8796 -1.9107 -0.3918 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7241 -1.1131 -1.2934 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4532 -2.5336 0.4684 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9571 -1.8130 -0.2325 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9686 -0.3137 0.0645 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7928 0.3424 -0.4703 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4875 -0.0200 -0.0556 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2957 -0.9398 0.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3193 0.6896 -0.6425 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0499 0.1309 -0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8976 0.8101 -0.6065 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5655 0.4789 -0.2138 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4196 -0.4293 0.6429 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3856 1.1559 -0.7714 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7356 2.1207 -1.7152 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 1.8863 0.2968 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 2.9310 0.9657 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1424 0.9108 1.3644 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5814 2.5583 -0.3719 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4183 1.6436 -1.0066 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6871 2.4861 -1.7107 P 0 0 1 0 0 5 0 0 0 0 0 0 -2.8554 3.7926 -0.9731 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3693 2.8039 -3.3396 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1536 1.6513 -1.5533 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6623 1.5908 0.0450 P 0 0 2 0 0 5 0 0 0 0 0 0 -5.2838 2.9473 0.3824 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3088 1.4301 1.0671 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7984 0.4049 0.3417 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2979 -0.6269 1.1395 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3483 -1.6862 1.3951 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4064 -1.0840 2.0388 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5476 -1.2899 1.3159 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.5474 -0.2651 1.5088 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0013 0.1168 2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9316 1.0960 2.5603 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.0499 1.3176 1.2509 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8591 2.2111 0.5654 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7518 3.0899 1.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7519 2.2001 -0.7745 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.9001 1.3626 -1.4229 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1269 0.5062 -0.7317 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1842 0.4661 0.5958 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0887 -1.3662 -0.1252 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.0222 -2.0099 -0.9304 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8357 -2.1972 0.0580 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.1875 -3.5276 0.2298 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4227 -4.5748 -0.8224 P 0 0 0 0 0 5 0 0 0 0 0 0 -5.2779 -5.2988 -0.1153 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 -3.8239 -2.1776 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5392 -5.7992 -1.2422 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3115 0.1940 -1.0186 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1489 0.0553 0.3142 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5522 0.3176 -1.4246 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2375 -1.9942 -1.9355 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2967 -2.0444 -0.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3926 -2.1193 1.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3101 -3.4498 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8643 -1.9945 -1.3241 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0986 -2.2993 0.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9810 -0.1921 1.1771 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8904 0.1540 -0.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9253 1.0868 -1.1663 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3264 0.6056 -1.7398 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4324 1.7782 -0.4144 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 0.2346 1.0445 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0256 -0.9465 -0.3177 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0308 1.5522 -1.3068 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7155 0.4171 -1.2445 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0834 1.7168 -2.5557 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7964 3.8174 1.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8848 2.6077 1.9204 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1874 3.2745 0.2189 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7081 1.3361 1.9523 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9451 0.6909 2.0849 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1519 -0.0481 0.8577 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2257 3.0862 0.3778 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2488 3.3488 -1.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1237 1.9812 -3.8309 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5921 1.7971 1.9534 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9895 -0.1467 2.0971 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4178 -1.0352 0.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8756 -2.4913 1.9972 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9346 -2.3067 1.5794 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7202 -0.2493 3.6881 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7220 3.2334 0.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4116 3.5842 2.0885 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8860 1.4296 -2.5022 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8452 -0.3537 -0.4802 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5061 -2.5524 -1.5953 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1011 -2.0325 -0.7501 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 -4.4757 -2.9368 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2523 -5.8641 -0.5404 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 1 0 19 22 1 0 22 23 1 0 24 23 1 1 24 26 1 0 24 25 2 0 24 27 1 0 28 27 1 6 28 30 1 0 28 29 2 0 28 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 46 1 0 46 47 1 0 46 48 1 0 48 49 1 0 49 50 1 0 50 52 1 0 50 53 1 0 50 51 2 0 35 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 45 2 0 45 44 1 0 44 43 2 0 43 42 1 0 42 40 2 0 40 41 1 0 48 33 1 0 45 36 1 0 40 39 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 7 61 1 0 7 62 1 0 8 63 1 0 8 64 1 0 9 65 1 0 12 66 1 0 12 67 1 0 13 68 1 0 13 69 1 0 14 70 1 0 17 71 1 6 18 72 1 0 20 73 1 0 20 74 1 0 20 75 1 0 21 76 1 0 21 77 1 0 21 78 1 0 22 79 1 0 22 80 1 0 26 81 1 0 30 82 1 0 32 83 1 0 32 84 1 0 33 85 1 1 35 86 1 1 46 91 1 6 47 92 1 0 48 93 1 6 52 94 1 0 53 95 1 0 37 87 1 0 43 90 1 0 41 88 1 0 41 89 1 0 M END