RDKit 3D 82 83 0 0 0 0 0 0 0 0999 V2000 -5.0058 -1.5790 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1748 -1.0305 -0.1545 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2544 0.2791 0.1079 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4772 0.9481 1.1944 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0447 0.5457 2.5404 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5847 2.4214 1.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5021 3.2484 1.6154 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6217 4.6276 0.9896 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2556 2.7279 1.6845 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0352 3.0239 1.5805 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7646 3.6847 2.3727 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 2.5107 0.3490 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0508 3.0319 -0.9038 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9074 2.8408 -2.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1567 2.4574 -1.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0481 1.1897 0.3735 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2636 0.0147 0.4579 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9115 -0.8186 1.5448 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9669 -0.7343 -0.6456 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2133 -0.1171 -1.1341 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3321 0.0857 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2919 -0.9015 -0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3869 -0.8067 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5649 0.3201 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6458 0.4654 2.3224 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6109 1.3075 1.3926 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8242 3.0513 2.5834 I 0 0 0 0 0 0 0 0 0 0 0 0 4.5292 1.1855 0.5601 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0383 -2.1508 -0.4265 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6633 -2.6080 0.8244 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5809 -3.1655 -1.2988 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3281 -4.1660 -1.5438 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2568 -3.1913 -1.9955 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5733 -3.3047 -3.5079 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5679 -2.0953 -1.8205 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -1.7886 -1.1869 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0693 -0.4546 -1.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3173 -2.7086 -0.3075 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3844 -3.5213 0.5547 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3215 -1.9872 0.5803 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8493 -2.1864 -0.8414 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4177 -2.2747 -1.8913 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4341 -0.7795 -1.8991 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9277 0.9100 -0.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4016 0.6776 1.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 1.3637 3.0496 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7461 -0.3066 2.4691 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1713 0.3035 3.2169 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 2.7418 1.4624 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 2.7161 -0.0648 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8409 3.4309 2.6865 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6487 4.4949 -0.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7148 5.2219 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5183 5.1341 1.3798 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7559 3.0953 0.2671 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0967 4.1463 -0.8109 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8493 1.7659 -2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4765 3.4261 -2.9626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9863 3.0560 -1.9369 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6694 3.0017 -1.7639 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3299 -0.6351 2.4306 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2323 -0.6161 -1.5063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5708 -0.7901 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9396 0.8227 -1.7082 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2151 -1.8052 -0.7343 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1609 -1.5708 0.7726 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7219 1.3066 2.8754 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8304 1.9859 0.5415 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4178 -3.3849 0.5184 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0957 -1.8073 1.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -3.1423 1.4911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1692 -4.1871 -1.7524 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3559 -3.6368 -4.0231 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9266 -2.3240 -3.8249 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3418 -4.0756 -3.6281 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0534 -0.0364 -2.2749 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9133 -3.4019 -0.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8642 -3.5840 1.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4175 -3.0501 0.7263 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3303 -4.5944 0.2457 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9304 -2.7534 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7186 -1.4962 1.3847 H 0 0 0 0 0 0 0 0 0 0 0 0 14 13 1 0 13 15 1 0 13 12 1 0 12 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 24 26 1 0 26 27 1 0 26 28 2 0 19 29 1 0 29 30 1 0 29 31 1 0 31 32 2 0 31 33 1 0 33 34 1 0 33 35 1 0 35 36 2 0 36 37 1 0 36 38 1 0 38 39 1 0 38 40 1 0 40 2 1 0 2 1 1 0 2 3 2 0 3 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 28 21 1 0 14 57 1 0 14 58 1 0 14 59 1 0 13 56 1 1 15 60 1 0 12 55 1 1 18 61 1 0 19 62 1 6 20 63 1 0 20 64 1 0 22 65 1 0 23 66 1 0 25 67 1 0 28 68 1 0 30 69 1 0 30 70 1 0 30 71 1 0 33 72 1 1 34 73 1 0 34 74 1 0 34 75 1 0 37 76 1 0 38 77 1 6 39 78 1 0 39 79 1 0 39 80 1 0 40 81 1 0 40 82 1 0 1 41 1 0 1 42 1 0 1 43 1 0 3 44 1 0 4 45 1 1 5 46 1 0 5 47 1 0 5 48 1 0 6 49 1 0 6 50 1 0 7 51 1 1 8 52 1 0 8 53 1 0 8 54 1 0 M END