RDKit 3D 96101 0 0 0 0 0 0 0 0999 V2000 12.6949 -2.8275 -0.1655 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6522 -2.1068 -0.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -2.1000 -0.1916 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3686 -1.3856 -0.7902 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1106 -1.3368 -0.2844 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8202 -2.0265 0.8818 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4599 -1.9545 1.3974 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0604 -2.5869 2.5521 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 -2.4909 3.0098 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3964 -3.0707 4.0606 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8473 -1.7532 2.2898 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5288 -1.6102 2.6746 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -2.1786 3.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6854 -0.8274 1.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1152 -0.2120 0.7116 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2916 0.5442 -0.0843 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0731 0.8287 0.1143 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7480 -0.0970 -0.7096 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0629 0.2582 -0.9593 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8008 -0.9655 -1.4349 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1413 -0.6768 -1.7188 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8086 -1.8060 -2.1244 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3287 -1.7749 -3.3895 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6549 -2.1029 -3.4838 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.0121 -2.2636 -4.9439 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0333 -3.3983 -2.8010 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.5189 -3.3268 -2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 -3.5901 -1.4815 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1270 -4.2945 -1.7453 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8604 -2.1926 -1.0705 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1815 -2.2529 0.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1297 1.4057 -1.9464 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3439 2.0539 -1.8488 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9442 2.3249 -1.7462 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0237 2.1172 -2.7191 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3762 2.1966 -0.3452 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1944 2.9069 0.5656 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 4.0757 1.0223 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3250 4.0260 2.3855 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4501 3.9060 3.1663 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0715 4.0399 4.6124 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5542 4.8582 2.8006 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7220 4.2096 2.4356 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1116 5.9098 1.8189 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2326 6.8168 2.3625 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4511 5.2533 0.6260 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7108 6.1228 -0.1411 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4444 -0.3775 0.3586 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3063 -1.1391 1.1349 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5670 -1.2609 0.7429 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8259 -2.7397 1.4871 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1062 -2.7831 0.9632 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3347 -3.7700 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1927 -2.1565 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5053 -3.0535 -0.9177 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6073 -0.8434 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3254 -0.7624 -0.7839 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7545 -3.1691 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3921 -2.7351 4.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6727 -0.7380 2.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3373 0.6215 1.1791 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5137 0.5605 0.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6648 -1.8316 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3471 -1.2225 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0848 -2.6739 -2.1113 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3203 -1.2784 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9642 -1.7188 -5.1903 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2301 -1.7554 -5.5408 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0562 -3.3298 -5.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8533 -4.2740 -3.4455 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6196 -2.8466 -1.4727 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8576 -4.3834 -2.3407 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0848 -2.8055 -3.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9135 -4.0945 -0.7161 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2400 -4.9332 -2.4816 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6778 -1.4711 -1.0458 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8428 -3.1376 0.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0507 0.9750 -2.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9661 1.6891 -2.5331 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 3.3587 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2501 2.9755 -3.1763 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5727 2.7853 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3826 4.1763 0.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8576 2.8749 3.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3778 5.0782 4.9284 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 3.9584 4.8114 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 3.2774 5.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8197 5.4201 3.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8847 4.1285 1.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0322 6.4620 1.5166 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 7.5840 1.7558 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 4.8516 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1163 6.4072 0.3171 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7967 0.1150 -0.5577 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6229 -3.2941 2.4057 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8304 -3.3658 1.5066 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 51 1 0 51 52 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 19 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 15 48 1 0 48 49 2 0 49 50 1 0 52 3 1 0 50 7 1 0 49 11 1 0 36 17 1 0 46 38 1 0 30 22 1 0 1 53 1 0 1 54 1 0 1 55 1 0 4 56 1 0 5 57 1 0 51 95 1 0 52 96 1 0 8 58 1 0 13 59 1 0 14 60 1 0 17 61 1 1 19 62 1 1 20 63 1 0 20 64 1 0 22 65 1 6 24 66 1 1 25 67 1 0 25 68 1 0 25 69 1 0 26 70 1 6 27 71 1 0 27 72 1 0 27 73 1 0 28 74 1 1 29 75 1 0 30 76 1 1 31 77 1 0 32 78 1 6 33 79 1 0 34 80 1 1 35 81 1 0 36 82 1 6 38 83 1 6 40 84 1 1 41 85 1 0 41 86 1 0 41 87 1 0 42 88 1 1 43 89 1 0 44 90 1 6 45 91 1 0 46 92 1 6 47 93 1 0 48 94 1 0 M END