RDKit 3D 102106 0 0 0 0 0 0 0 0999 V2000 7.9146 -0.1909 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8197 -1.0489 -0.5105 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0625 -0.5581 0.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3228 0.8429 0.8953 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9654 -1.3527 1.0403 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7733 -0.6419 1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9339 -0.8361 0.0146 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4195 0.5315 -0.4765 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9351 1.3379 0.7212 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9653 0.5069 1.4729 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1562 -0.9501 1.4939 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1986 -1.6329 1.6316 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5266 -2.3634 0.3971 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6679 -2.3052 -0.2727 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6598 -2.6979 -1.7056 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8747 -1.8596 0.4303 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9164 -2.8037 0.2695 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5354 -3.4313 1.3454 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1253 -3.1200 2.4837 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6173 -4.4140 1.1918 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0864 -4.8807 2.5421 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1043 -5.6350 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3536 -0.4606 -0.0081 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7532 0.3437 1.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2793 0.0618 -0.8296 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4185 0.8836 -1.8513 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2894 1.9900 -1.8024 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 2.9382 -0.9253 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2635 3.8056 -0.3359 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 5.0342 -0.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4048 4.8891 -0.1018 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5290 5.8854 -0.7682 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3718 6.9359 -1.2285 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8184 5.3915 -1.9398 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5553 6.3137 -3.1074 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4035 4.1548 -1.9916 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6508 3.2475 -0.8623 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4245 3.3197 0.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2003 4.2025 1.0782 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5175 2.5554 0.2759 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9768 3.4433 -0.2721 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8720 2.9603 1.0627 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7575 -1.5151 0.3781 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5099 -1.5273 -1.1729 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4535 -1.7892 -2.0538 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0641 -2.8605 -0.7589 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8185 -2.7362 0.5210 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1606 -3.5568 1.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7561 0.8737 -0.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9141 -0.5513 -0.7376 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8940 -0.3585 -2.1826 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7370 -2.0355 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1121 1.5677 0.0975 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6791 1.0571 1.7662 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3722 0.9720 1.2234 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.4568 2.1291 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5752 0.3914 -1.1715 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2099 1.1051 -0.9811 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8613 1.3765 1.3814 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0948 0.7422 1.1849 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0072 0.8716 2.5488 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7521 -1.2285 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9192 -0.9045 1.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1023 -2.3914 2.4348 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -3.0166 0.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0416 -3.7332 -1.8551 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6225 -2.7112 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2131 -1.9632 -2.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7139 -1.7809 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4978 -4.0114 0.6378 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9216 -4.1254 3.3367 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5222 -5.8096 2.8294 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1542 -5.1622 2.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9377 -6.2077 0.0126 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4177 -5.3154 -0.3482 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6042 -6.2929 1.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3286 -0.5798 -0.5712 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8251 0.5362 1.7874 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3184 -0.4051 1.8562 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3670 1.2187 1.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2274 -0.2387 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 0.6263 -2.7572 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1055 2.1111 -2.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2344 3.6652 -0.8457 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2889 3.6100 0.7336 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5109 5.1702 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9048 6.4070 -0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8264 7.3655 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3203 7.2955 -2.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 5.9397 -3.6071 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4284 6.3401 -3.7861 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1306 3.8464 -2.9143 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4662 2.2341 -1.2843 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4828 3.4655 1.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2192 -0.9043 -1.7546 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1858 -2.7414 -2.0521 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1795 -3.5331 -0.5749 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6636 -3.3556 -1.5648 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8211 -3.1939 0.3928 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9807 -4.5874 1.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2828 -3.0359 2.0709 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9186 -3.5645 2.4808 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 3 5 1 0 5 6 1 0 7 6 1 1 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 20 22 1 0 16 23 1 0 23 24 1 0 23 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 2 0 36 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 37 41 1 0 41 42 1 1 11 43 1 0 7 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 47 48 1 0 47 5 1 0 43 7 1 0 40 9 1 0 41 28 1 0 41 31 1 0 1 49 1 0 1 50 1 0 1 51 1 0 2 52 1 0 4 53 1 0 4 54 1 0 4 55 1 0 5 56 1 1 8 57 1 0 8 58 1 0 9 59 1 1 10 60 1 0 10 61 1 0 11 62 1 1 12 63 1 0 12 64 1 0 13 65 1 0 15 66 1 0 15 67 1 0 15 68 1 0 16 69 1 1 20 70 1 6 21 71 1 0 21 72 1 0 21 73 1 0 22 74 1 0 22 75 1 0 22 76 1 0 23 77 1 6 24 78 1 0 24 79 1 0 24 80 1 0 25 81 1 0 26 82 1 0 27 83 1 0 29 84 1 0 29 85 1 0 31 86 1 1 32 87 1 1 33 88 1 0 35 89 1 0 35 90 1 0 35 91 1 0 36 92 1 0 37 93 1 6 42 94 1 0 44 95 1 6 45 96 1 0 46 97 1 0 46 98 1 0 47 99 1 6 48100 1 0 48101 1 0 48102 1 0 M END