RDKit 3D 163163 0 0 0 0 0 0 0 0999 V2000 -7.7785 6.5624 -0.4815 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9733 5.5956 0.6342 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3923 4.3819 0.6443 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5773 4.0580 -0.4569 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2891 3.4781 -0.4938 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2067 2.3027 -1.0194 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0241 4.0546 -0.0120 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0837 4.9072 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5769 4.1815 2.3463 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4322 4.7545 -1.1565 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4587 4.2263 -2.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6325 4.2280 -3.2627 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1481 3.6240 -1.5386 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0729 4.7035 -1.7423 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 4.2440 -1.4102 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8127 2.5102 -2.4003 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9075 1.1474 -2.1276 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 0.4626 -2.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 0.3748 -1.0444 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1336 0.8172 -0.8567 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2365 0.0203 -1.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9727 -1.1185 -1.7626 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6496 0.4127 -1.1176 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8898 1.7169 -1.9186 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5289 1.4705 -3.6373 S 0 0 1 0 0 6 0 0 0 0 0 0 2.0648 1.1456 -3.7898 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8352 2.7470 -4.3727 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5158 0.2649 -4.2826 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5218 -0.6141 -1.6296 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8900 -0.7874 -1.3359 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4436 0.0307 -0.5561 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6397 -1.9165 -1.9498 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0913 -1.7225 -1.8201 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7379 -1.4754 -2.8165 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7833 -1.8141 -0.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2945 -3.1607 -0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2053 -3.8613 -1.0533 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5078 -3.3854 -1.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5735 -3.0898 -0.5412 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4095 -1.9125 0.3992 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3122 -0.6340 -0.3453 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1075 0.5653 0.4817 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1315 1.0243 1.4152 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5664 2.3097 2.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6363 0.1726 2.5023 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5973 -0.3154 3.4708 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0601 0.3412 0.2043 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5044 0.3042 -0.2595 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7214 -0.6196 1.1339 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4548 -1.9325 1.0567 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -2.4557 1.3237 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5404 -2.8865 0.6242 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6145 -2.7836 1.5878 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1726 -2.7329 3.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9807 -2.7089 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6618 -1.7709 1.9152 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8412 -3.6307 0.5209 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0778 -4.7745 0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7865 -5.7217 -0.8671 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9473 -6.5066 -0.4722 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2205 -5.8378 -0.0899 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1963 -6.9222 0.1766 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5989 -2.9107 -0.4639 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2975 -1.7026 -0.3502 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9359 -0.7309 -1.1445 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4108 -1.3314 0.5408 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.1823 -2.5461 1.0609 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3044 -2.0971 1.7917 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3985 -0.6136 -0.2968 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7537 0.7338 -0.1388 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7738 1.4144 -1.2229 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1024 1.4572 1.0902 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.3730 2.2559 0.9893 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.5913 2.9493 2.3262 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5544 3.1132 -0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0056 2.1332 1.7364 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6959 3.4948 1.7855 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6559 4.0933 2.9247 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8395 6.3042 -1.0048 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6280 7.5553 0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6586 6.5388 -1.1619 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6004 5.8860 1.4664 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0406 4.3022 -1.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3491 3.1798 0.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0354 5.1968 1.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6087 5.8721 1.0474 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8588 3.1989 2.0345 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8688 4.0514 3.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7694 5.7320 -1.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2755 3.3785 -0.4872 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 5.5530 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1109 5.0783 -2.7943 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4194 4.4229 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4593 2.8190 -3.3714 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1366 -0.7119 -1.3725 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3059 1.7445 -0.4184 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9261 0.6940 -0.0981 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9388 1.9995 -1.7288 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2574 2.5032 -1.4683 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7519 0.5278 -5.1924 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0899 -1.3274 -2.3057 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2567 -2.8361 -1.4509 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3396 -1.9337 -3.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9461 -1.6207 0.2476 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4609 -0.9632 -0.3144 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3441 -3.8187 -0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6149 -3.1176 0.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6103 -4.2421 -1.9796 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3988 -4.8917 -0.5597 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4433 -2.5038 -2.2055 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9367 -4.1843 -2.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5504 -2.9650 -1.0656 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7461 -3.9699 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6271 -2.0435 1.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3722 -1.9140 0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2877 -0.5291 -0.9645 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5514 -0.6360 -1.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1037 0.4963 1.0395 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8721 1.4804 -0.1905 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0332 1.4126 0.8447 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9004 2.0434 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9935 2.8976 1.3394 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4376 2.8795 2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3751 -0.5815 2.2796 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2532 0.9288 3.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6346 -0.5556 3.0131 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9945 -1.2727 3.9175 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4388 0.3818 4.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9582 1.3436 0.7243 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2316 0.3309 0.5508 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6449 1.2450 -0.8606 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6418 -0.5045 -1.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7906 -2.6040 -0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1707 -3.9352 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0966 -2.4859 3.0859 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4008 -3.6773 3.5264 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7819 -1.9326 3.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5215 -4.0659 1.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1504 -4.4624 -0.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7276 -5.3657 0.9141 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0469 -5.2318 -1.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0236 -6.5141 -1.2686 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2479 -7.2371 -1.3097 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6477 -7.2659 0.3392 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2219 -5.2321 0.8115 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6642 -5.2294 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7182 -7.0951 -0.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6384 -7.7595 0.4283 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6152 -3.3897 -1.4318 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1442 -0.7424 1.4186 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5827 -3.0956 1.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5482 -3.1786 0.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0243 -1.9602 1.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8161 -1.2406 -1.0537 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4103 0.6204 1.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2128 1.4900 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6453 2.8983 2.6647 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3301 4.0338 2.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9918 2.4382 3.1252 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1856 3.9988 0.1374 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2199 2.6424 -0.9822 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6902 3.4699 -0.7333 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3324 1.4930 2.2674 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 7 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 13 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 2 0 25 28 1 6 23 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 19 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 50 51 2 0 50 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 55 56 2 0 55 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 57 63 1 0 63 64 1 0 64 65 2 0 64 66 1 0 66 67 1 0 67 68 1 0 66 69 1 0 69 70 1 0 70 71 2 0 70 72 1 0 72 73 1 0 73 74 1 0 73 75 1 0 72 76 1 0 76 77 1 0 77 78 2 0 77 3 1 0 1 79 1 0 1 80 1 0 1 81 1 0 2 82 1 0 4 83 1 0 7 84 1 1 8 85 1 0 8 86 1 0 9 87 1 0 9 88 1 0 10 89 1 0 13 90 1 1 14 91 1 0 14 92 1 0 15 93 1 0 16 94 1 0 19 95 1 6 20 96 1 0 23 97 1 1 24 98 1 0 24 99 1 0 28100 1 0 29101 1 0 32102 1 0 32103 1 0 35104 1 0 35105 1 0 36106 1 0 36107 1 0 37108 1 0 37109 1 0 38110 1 0 38111 1 0 39112 1 0 39113 1 0 40114 1 0 40115 1 0 41116 1 0 41117 1 0 42118 1 0 42119 1 0 43120 1 6 44121 1 0 44122 1 0 44123 1 0 45124 1 0 45125 1 0 46126 1 0 46127 1 0 46128 1 0 47129 1 1 48130 1 0 48131 1 0 48132 1 0 52133 1 0 52134 1 0 54135 1 0 54136 1 0 54137 1 0 57138 1 1 58139 1 0 58140 1 0 59141 1 0 59142 1 0 60143 1 0 60144 1 0 61145 1 0 61146 1 0 62147 1 0 62148 1 0 63149 1 0 66150 1 1 67151 1 0 67152 1 0 68153 1 0 69154 1 0 72155 1 1 73156 1 6 74157 1 0 74158 1 0 74159 1 0 75160 1 0 75161 1 0 75162 1 0 76163 1 0 M END