RDKit 3D 81 84 0 0 0 0 0 0 0 0999 V2000 -3.9994 5.7675 3.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5934 4.6203 2.0965 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3828 4.9522 1.5518 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0574 4.3736 0.3582 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8756 2.9947 0.3989 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5812 2.6157 0.0503 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0666 2.0181 1.2679 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6808 2.9802 2.0495 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1095 1.0273 0.7557 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9649 0.5156 1.8791 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8394 -0.4640 1.4003 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7814 -0.1775 0.4593 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8652 1.0024 0.0143 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7178 -1.1642 -0.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7423 -2.4140 0.2938 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6516 -3.4362 -0.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5605 -4.7304 0.2814 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4137 -5.7364 -0.1656 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3767 -5.4603 -1.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2454 -6.4348 -1.5815 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4964 -4.1838 -1.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4702 -3.8962 -2.5743 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6289 -3.2060 -1.1475 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3955 -0.0275 0.2547 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1937 0.3062 -0.9389 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2541 -0.6180 -1.0889 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0848 -1.4828 -2.1383 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3273 -2.3859 -2.1315 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4422 -1.5369 -2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4496 -3.1250 -0.8525 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7787 -2.5236 0.3425 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8795 -3.2833 1.5018 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6595 -4.6505 1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7705 -5.3723 2.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3301 -5.2490 0.3174 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1071 -6.6113 0.3074 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2296 -4.4876 -0.8418 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6434 1.7020 -1.1193 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0848 2.2874 -2.1662 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0321 4.7893 -0.7128 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5973 5.9917 -1.2978 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4282 5.0113 -0.2208 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7533 6.3534 -0.0678 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6834 4.3240 1.1044 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8842 2.9807 0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3593 6.6648 2.8292 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9156 5.4832 4.1002 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0561 6.0089 2.7829 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5439 3.7131 2.7693 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0711 4.8255 0.0498 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0115 3.5550 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6714 1.4588 1.8747 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2722 3.5006 1.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6697 1.5760 -0.0148 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3481 0.0861 2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5678 1.3586 2.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4265 -0.8423 -0.8183 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0041 -2.6998 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7962 -4.9432 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3409 -6.7536 0.2162 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9518 -6.2443 -2.2692 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5146 -2.9333 -2.9091 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7278 -2.2059 -1.5472 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5441 0.0430 -1.7584 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2158 -2.1602 -1.9935 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0973 -0.9874 -3.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3366 -3.0592 -2.9998 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2307 -0.6421 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9572 -1.4437 0.3583 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1365 -2.8286 2.4517 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0154 -4.8912 3.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8648 -7.1524 -0.4917 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9721 -4.9549 -1.7816 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6993 1.6514 -1.5304 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2481 1.9200 -3.0155 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0241 4.0476 -1.5655 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8295 5.8473 -1.8995 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1943 4.5815 -0.9284 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2481 6.9610 -0.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6302 4.7446 1.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 2.7593 -0.0842 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 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 2 0 9 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 33 35 1 0 35 36 1 0 35 37 2 0 25 38 1 0 38 39 1 0 4 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 44 2 1 0 38 6 1 0 23 16 1 0 37 30 1 0 1 46 1 0 1 47 1 0 1 48 1 0 2 49 1 1 4 50 1 6 6 51 1 6 7 52 1 1 8 53 1 0 9 54 1 6 10 55 1 0 10 56 1 0 14 57 1 0 15 58 1 0 17 59 1 0 18 60 1 0 20 61 1 0 22 62 1 0 23 63 1 0 25 64 1 6 27 65 1 0 27 66 1 0 28 67 1 6 29 68 1 0 31 69 1 0 32 70 1 0 34 71 1 0 36 72 1 0 37 73 1 0 38 74 1 6 39 75 1 0 40 76 1 6 41 77 1 0 42 78 1 6 43 79 1 0 44 80 1 1 45 81 1 0 M END