RDKit 3D 87 87 0 0 0 0 0 0 0 0999 V2000 9.3677 2.0574 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1653 1.8165 1.3737 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4589 0.5363 0.9783 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4037 -0.6111 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9379 0.6960 -0.4335 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2152 -0.5485 -0.9035 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0383 -0.8893 -0.0458 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9915 0.1706 0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3923 0.5105 -1.3209 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.6569 -1.9898 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5988 -1.2505 -1.1913 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5059 -0.2669 -0.9228 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6409 -0.9176 -0.1153 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2725 -2.0420 -0.8654 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7203 -1.7362 -2.2347 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7942 -1.6938 -3.1297 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0231 -1.4872 -2.6943 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9452 -0.4618 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7712 -0.8280 -1.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7712 -2.0272 -0.7634 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5603 0.0954 -0.3828 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1513 1.3630 0.1119 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2037 2.4026 -0.1584 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6135 2.6916 -1.5269 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2895 1.5906 -2.2831 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5117 1.2253 -1.5642 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8559 1.3568 1.5956 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2069 2.4698 2.1723 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 0.4060 2.3913 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9327 -0.1187 2.5109 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9826 -1.5957 2.6128 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6846 -2.3022 2.8035 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8608 -1.9406 3.8248 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0366 0.5008 1.5337 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6377 1.6866 1.9425 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5368 0.1222 0.3085 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9508 1.1268 0.4028 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9931 2.8256 0.9775 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0657 2.3661 -0.5419 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 2.6817 1.3835 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5689 1.6363 2.4046 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6347 0.3958 1.7113 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9425 -1.4521 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7935 -0.9601 0.1478 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2932 -0.3057 1.7218 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3346 1.6057 -0.5119 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8214 0.8179 -1.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9199 -0.3879 -1.9478 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9363 -1.3841 -0.8519 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6163 -1.8432 -0.4184 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3877 -1.0781 0.9905 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4517 1.1161 0.4006 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2197 -0.1084 0.7335 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1773 0.8843 -1.9862 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 1.3222 -1.1721 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4588 -1.3984 -2.3209 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 -0.2507 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0726 -1.5134 -0.1887 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3111 -2.2115 -1.6095 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8999 0.5996 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1298 0.1192 -1.8905 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0685 -1.3935 0.7272 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -2.9016 -0.8433 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1182 -2.4074 -0.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -2.1487 -3.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5022 0.5572 -2.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7038 -0.2795 -3.1362 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5628 -0.1935 -0.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2086 1.7381 -0.3439 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1268 2.1559 0.4383 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8208 3.3636 0.3335 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7878 3.0531 -2.1955 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3435 3.5580 -1.5323 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6415 1.9433 -3.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7001 0.6950 -2.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7253 1.8548 -0.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5762 0.2212 -1.3877 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9501 -0.0776 3.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5445 0.2149 3.5385 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5044 -2.0867 1.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3974 -2.9386 1.9506 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8566 -1.5516 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -2.9952 3.6782 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8019 -1.0930 4.5148 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9082 -2.0672 3.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5004 -2.8761 4.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8592 0.7278 -0.5319 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 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 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 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 22 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 30 34 1 0 34 35 2 0 34 36 1 0 36 13 1 0 1 37 1 0 1 38 1 0 1 39 1 0 2 40 1 0 2 41 1 0 3 42 1 1 4 43 1 0 4 44 1 0 4 45 1 0 5 46 1 0 5 47 1 0 6 48 1 0 6 49 1 0 7 50 1 0 7 51 1 0 8 52 1 0 8 53 1 0 9 54 1 0 9 55 1 0 10 56 1 0 10 57 1 0 11 58 1 0 11 59 1 0 12 60 1 0 12 61 1 0 13 62 1 1 14 63 1 0 14 64 1 0 17 65 1 0 18 66 1 0 18 67 1 0 21 68 1 0 22 69 1 6 23 70 1 0 23 71 1 0 24 72 1 0 24 73 1 0 25 74 1 0 25 75 1 0 26 76 1 0 26 77 1 0 29 78 1 0 30 79 1 1 31 80 1 6 32 81 1 0 32 82 1 0 32 83 1 0 33 84 1 0 33 85 1 0 33 86 1 0 36 87 1 0 M END