RDKit 3D 117120 0 0 0 0 0 0 0 0999 V2000 10.3794 3.8873 -2.2221 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5818 2.7056 -2.0163 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6171 2.6521 -1.0223 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4452 3.6431 -0.2919 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7901 1.4381 -0.8194 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9157 1.6382 0.3984 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0444 0.4785 0.6011 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6481 0.6083 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1528 1.7739 0.5005 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -0.5771 0.8164 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4051 -0.2254 0.7656 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -0.8016 1.2949 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2872 -1.8435 1.9642 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1189 -0.1800 1.0759 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9441 -1.2846 0.6735 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0913 -1.1661 -0.2203 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8845 -0.3830 -1.1922 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5737 0.0644 -2.2659 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0983 1.4419 -2.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6937 2.1884 -3.3425 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0019 2.1116 -1.5066 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9852 3.1796 -1.7877 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6327 4.1775 -0.6735 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8284 3.4091 0.3399 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1581 1.9496 -0.0841 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.5089 1.6520 0.4115 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2715 2.6819 0.5928 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0979 0.4298 0.7224 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3957 -0.7007 -0.1136 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.8243 -0.5819 -0.6943 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.0390 -1.8088 -1.5417 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7591 -0.5621 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4870 -0.9652 -1.2224 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7429 -0.4474 -2.3469 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3103 -1.7687 -1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3444 -1.8270 -0.1299 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3497 -3.2938 0.2746 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8027 -3.5646 1.6476 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7409 -3.9097 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5303 -4.1599 -0.6678 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4263 0.3499 2.4607 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7296 1.0384 2.6212 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 1.3660 2.7926 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3419 -0.7296 3.5246 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1523 -1.6116 -0.2602 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3307 -2.8824 -0.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9626 -1.0998 -1.6289 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0386 -0.8328 -2.4247 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8868 -0.3602 -3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6139 -0.1570 -4.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5139 -0.4339 -3.3901 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6982 -0.8965 -2.1225 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8573 1.7329 1.5824 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1653 1.9396 1.5499 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8465 1.9887 2.6488 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1672 1.8203 3.8277 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5607 1.5990 3.2634 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5967 3.8955 -3.3229 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3055 3.8728 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8051 4.8003 -1.9503 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1079 1.2967 -1.7092 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4164 0.5259 -0.6932 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3907 2.5733 0.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4867 -0.4513 0.7193 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0106 -1.0864 1.7554 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2198 0.6835 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0659 0.6599 0.3879 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7253 -2.2182 1.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1622 -0.6404 -2.9036 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6704 0.1288 -3.0492 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7521 3.7104 -2.7327 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0101 2.8776 -1.6707 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5206 4.6853 -0.2628 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9683 4.9881 -1.0509 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3085 3.5390 1.3226 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7611 3.6108 0.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3656 1.3103 0.3493 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3942 0.3159 1.7612 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4968 -1.6300 0.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8833 0.3732 -1.2947 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1385 -1.5522 -2.6272 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2743 -2.5977 -1.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0181 -2.2768 -1.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5441 -1.3153 0.3254 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2445 0.4346 0.5963 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2393 -0.7749 1.4469 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1093 -2.4452 -1.9893 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8876 -1.3611 0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6588 -2.6530 2.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8497 -4.1242 1.6301 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -4.2418 2.2138 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5453 -5.0177 0.3552 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2266 -3.8225 -0.7515 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3477 -3.6236 1.0969 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8909 -4.0898 -1.7081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7664 -5.2046 -0.3565 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4443 -4.0591 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8185 2.0248 2.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 1.2604 3.7153 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6095 0.3647 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4161 1.8984 3.7629 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6198 0.8478 3.0234 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7522 2.1726 2.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9671 -0.3657 4.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6851 -1.7033 3.1725 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6972 -0.7398 3.9182 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1968 -1.8520 -0.0702 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3933 -3.2045 0.9329 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -3.7027 -0.7249 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2845 -2.7334 -0.3991 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0766 -0.9647 -2.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7561 -0.1433 -4.3664 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 0.2115 -5.2362 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5418 -0.2538 -3.8373 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8021 -1.0958 -1.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9482 2.1640 2.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5629 1.8279 4.8570 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 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 2 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 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 29 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 1 37 39 1 0 37 40 1 0 14 41 1 0 41 42 1 6 41 43 1 0 41 44 1 0 10 45 1 0 45 46 1 0 45 47 1 0 47 48 2 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 2 0 6 53 1 0 53 54 2 0 54 55 1 0 55 56 2 0 56 57 1 0 36 16 1 0 52 47 1 0 57 53 1 0 25 21 1 0 1 58 1 0 1 59 1 0 1 60 1 0 5 61 1 0 5 62 1 0 6 63 1 6 7 64 1 0 10 65 1 1 11 66 1 0 14 67 1 6 15 68 1 0 18 69 1 0 18 70 1 0 22 71 1 0 22 72 1 0 23 73 1 0 23 74 1 0 24 75 1 0 24 76 1 0 25 77 1 1 28 78 1 0 29 79 1 1 30 80 1 6 31 81 1 0 31 82 1 0 31 83 1 0 32 84 1 0 32 85 1 0 32 86 1 0 35 87 1 0 36 88 1 1 38 89 1 0 38 90 1 0 38 91 1 0 39 92 1 0 39 93 1 0 39 94 1 0 40 95 1 0 40 96 1 0 40 97 1 0 42 98 1 0 42 99 1 0 42100 1 0 43101 1 0 43102 1 0 43103 1 0 44104 1 0 44105 1 0 44106 1 0 45107 1 6 46108 1 0 46109 1 0 46110 1 0 48111 1 0 49112 1 0 50113 1 0 51114 1 0 52115 1 0 55116 1 0 56117 1 0 M END