RDKit 3D 149151 0 0 0 0 0 0 0 0999 V2000 14.0679 1.0980 -1.1506 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2192 -0.0911 -0.9387 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4482 -1.4947 -0.6846 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7471 -2.0089 0.5165 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2473 -2.0034 0.4087 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5950 -0.7080 0.1424 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0619 -0.8704 0.1597 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6914 -1.8623 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5795 -1.1320 1.5166 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4481 -1.2812 2.4433 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2422 -1.2354 1.9054 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8994 -1.5217 3.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1618 -1.0420 0.9527 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3644 -2.3518 0.9493 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3072 0.0980 1.3488 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3837 0.5348 2.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4193 0.6900 0.4176 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3552 0.1490 -0.9177 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5696 1.8079 0.7584 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1569 1.6339 0.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6064 2.6468 -0.1464 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4031 0.5040 0.6318 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7961 -0.7087 1.3531 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5751 -0.8605 2.2786 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4268 -0.1142 1.5517 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0257 0.1400 0.2417 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4331 0.9263 -0.7905 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3204 1.2686 -1.7203 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8262 1.4238 -1.0736 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0242 2.1778 -2.3277 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0512 1.3239 -0.2542 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9790 0.3714 -0.8035 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4032 -0.8145 -0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 0.3597 -1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1581 1.5212 -1.1126 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9446 -0.8092 -1.8186 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8244 -2.0765 -1.1609 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8723 -2.8608 -1.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5723 -2.6465 -0.1011 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1344 -4.0096 0.3076 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6730 -2.0882 0.6133 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2139 -1.0109 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2596 -0.3264 2.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7427 0.8849 1.8359 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7323 1.5954 2.4675 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2832 1.0870 3.6366 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2864 1.8102 4.2728 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8428 1.2874 5.4611 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8194 -0.1211 4.1324 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8225 -0.8035 3.4661 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9416 -1.9244 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8192 -1.2722 0.6976 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4551 -2.2804 -1.2755 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7173 -2.9950 -2.2767 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8265 -1.9497 -1.6314 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8772 -0.5997 -2.2973 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0260 0.5572 -1.6696 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0549 1.6584 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9266 1.5725 -3.7091 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7707 -0.1199 -3.9292 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6199 -0.9383 -3.2977 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1872 -1.0423 -3.6679 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4032 0.0120 -4.1565 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4141 2.6071 0.3448 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7675 3.7809 -0.4629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1993 2.5444 1.6335 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1683 3.0802 0.1755 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2833 4.2779 0.5782 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2736 3.1242 -1.3024 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9254 2.1328 -1.3172 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0700 -2.0769 -1.5897 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5576 -1.6814 -0.6333 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0342 -1.3646 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1073 -3.0668 0.7304 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8391 -2.5492 1.3159 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9572 -2.7224 -0.4185 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8713 0.1055 0.8192 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7946 -0.3824 -0.9284 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6452 0.1366 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3385 -2.8082 -0.4302 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9540 -1.4654 -1.6411 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5785 -2.0935 -1.5482 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3321 -2.4725 3.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8027 -1.6011 3.4331 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2935 -0.6743 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5294 -0.8262 -0.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3004 -2.0962 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6605 -2.9470 1.8668 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6297 -2.8827 0.0305 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6784 -0.9268 -0.9143 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3072 0.2210 -1.3209 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0871 0.6470 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7456 1.9634 1.8715 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8577 -1.5523 0.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6976 -0.5939 1.9474 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7512 -0.4744 3.2784 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3782 -1.9424 2.3361 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2552 0.7758 2.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3958 -0.8748 1.5901 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1834 -0.9094 -0.2534 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8701 3.2656 -2.1863 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9977 2.0227 -2.7786 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1848 1.8848 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6167 0.7405 0.6719 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0209 2.0410 -0.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9868 2.2448 -1.9668 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2451 1.2405 -1.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0724 -0.5308 -1.8895 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -3.9584 0.5636 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2525 -4.7153 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7114 -4.3679 1.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9652 -2.9385 1.4085 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5371 -1.4798 2.3464 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5410 -0.2788 1.0749 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3105 1.2793 0.9258 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1140 2.5345 2.1079 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3430 0.2975 5.2915 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6294 2.0034 5.8501 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0821 1.2207 6.2787 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2667 -0.4993 5.0514 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4859 -1.7580 3.8927 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0237 -3.7223 -1.8296 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4110 -3.6354 -2.9103 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2615 -2.2861 -2.9972 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2504 -2.6805 -2.3486 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4767 -1.8703 -0.7345 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1797 2.6513 -1.8604 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9302 2.4044 -4.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0511 -1.9710 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6709 -1.9711 -3.3559 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5975 -0.1201 -3.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0953 -1.1198 -4.8231 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1262 -0.5124 -4.8262 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0203 0.7372 -3.5914 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6983 0.5281 -4.8551 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3414 2.9650 0.7981 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6884 4.2472 0.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0435 4.6321 -0.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1173 3.5585 -1.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7322 1.5594 1.7656 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6433 2.7522 2.5416 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0419 3.2917 1.6036 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1588 3.2804 0.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 4.6542 -0.2917 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6012 4.0380 1.3977 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9213 5.1394 0.9224 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3289 2.9606 -1.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0609 4.1857 -1.6596 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6176 2.4780 -1.8755 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 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 2 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 46 49 1 0 49 50 2 0 41 51 1 0 51 52 2 0 51 53 1 0 53 54 1 0 53 55 1 0 55 56 1 0 56 57 2 0 57 58 1 0 58 59 2 0 59 60 1 0 36 61 1 0 61 62 1 0 61 63 1 0 31 64 1 0 64 65 1 0 64 66 1 0 19 67 1 0 67 68 1 0 67 69 1 0 26 22 1 0 50 43 1 0 60 56 1 0 1 70 1 0 3 71 1 0 3 72 1 0 4 73 1 0 4 74 1 0 5 75 1 0 5 76 1 0 6 77 1 0 6 78 1 0 7 79 1 6 8 80 1 0 8 81 1 0 8 82 1 0 12 83 1 0 12 84 1 0 12 85 1 0 13 86 1 6 14 87 1 0 14 88 1 0 14 89 1 0 18 90 1 0 18 91 1 0 18 92 1 0 19 93 1 1 23 94 1 0 23 95 1 0 24 96 1 0 24 97 1 0 25 98 1 0 25 99 1 0 26100 1 6 30101 1 0 30102 1 0 30103 1 0 31104 1 1 35105 1 0 35106 1 0 35107 1 0 36108 1 6 40109 1 0 40110 1 0 40111 1 0 41112 1 1 42113 1 0 42114 1 0 44115 1 0 45116 1 0 48117 1 0 48118 1 0 48119 1 0 49120 1 0 50121 1 0 54122 1 0 54123 1 0 54124 1 0 55125 1 0 55126 1 0 58127 1 0 59128 1 0 61129 1 6 62130 1 0 62131 1 0 62132 1 0 63133 1 0 63134 1 0 63135 1 0 64136 1 1 65137 1 0 65138 1 0 65139 1 0 66140 1 0 66141 1 0 66142 1 0 67143 1 1 68144 1 0 68145 1 0 68146 1 0 69147 1 0 69148 1 0 69149 1 0 M END