Z-matrix generated by ToolKit 1.0 1.0 1.0 90.0 90.0 90.0 72 0 C 0.0000000 0 0.000000 0 0.000000 0 0 0 0 3.0 1.0 11 C10 C 1.5449034 0 0.000000 0 0.000000 0 1 0 0 3.0 1.0 10 C9 C10 C 1.5621826 0 111.887612 0 0.000000 0 1 2 0 3.0 1.0 12 C11 C10 C9 H 1.0810973 0 108.563660 0 117.321245 0 1 2 3 6.0 1.0 44 H11 C10 C9 C11 H 0.9626769 0 111.898626 0 -124.771291 0 1 2 3 6.0 1.0 45 H12 C10 C9 C11 N 1.5282785 0 114.921288 0 -74.029931 1 2 1 3 3.0 1.0 9 N1 C9 C10 C11 H 1.0161192 0 111.616779 0 -118.663587 0 2 1 6 6.0 1.0 42 H9 C9 C10 N1 H 1.0029942 0 109.523404 0 118.482693 0 2 1 6 6.0 1.0 43 H10 C9 C10 N1 C 1.5424565 0 111.101066 0 167.574430 1 3 1 2 3.0 1.0 13 C12 C11 C10 C9 H 0.9965982 0 105.289713 0 118.568793 0 3 1 9 6.0 1.0 46 H13 C11 C10 C12 H 1.0043135 0 108.230482 0 -120.610813 0 3 1 9 6.0 1.0 47 H14 C11 C10 C12 C 1.5397542 0 110.802261 0 -55.493702 1 6 2 1 3.0 1.0 8 C8 N1 C9 C10 C 1.5042785 0 107.178854 0 -123.397448 0 6 2 12 3.0 1.0 24 C21 N1 C9 C8 H 0.9853613 0 107.528695 0 120.095537 0 6 2 12 6.0 1.0 41 H8 N1 C9 C8 C 1.5409413 0 111.048931 0 -65.959551 1 9 3 1 3.0 1.0 14 C13 C12 C11 C10 C 1.5723525 0 110.845752 0 -122.129945 0 9 3 15 3.0 1.0 25 C22 C12 C11 C13 C 1.4764919 0 108.996991 0 119.218750 0 9 3 15 3.0 1.0 28 C25 C12 C11 C13 C 1.5452285 0 108.993652 0 -178.018970 1 12 6 2 3.0 1.0 7 C7 C8 N1 C9 H 1.0787829 0 106.756683 0 -117.921871 0 12 6 18 6.0 1.0 39 H6 C8 N1 C7 H 1.0167145 0 110.873831 0 126.056227 0 12 6 18 6.0 1.0 40 H7 C8 N1 C7 H 0.8363952 0 103.040429 0 -172.158497 0 13 6 2 6.0 1.0 57 H24 C21 N1 C9 H 1.0089310 0 108.046253 0 119.211053 0 13 6 21 6.0 1.0 58 H25 C21 N1 H24 H 1.0242696 0 109.460465 0 -119.852518 0 13 6 21 6.0 1.0 59 H26 C21 N1 H24 C 1.3807278 0 123.494932 0 118.924029 1 15 9 3 3.0 1.0 15 C14 C13 C12 C11 C 1.4174384 0 115.510718 0 177.760897 0 15 9 24 3.0 1.0 19 C18 C13 C12 C14 C 1.5595721 0 111.512086 0 174.487075 1 16 9 3 3.0 1.0 26 C23 C22 C12 C11 C 1.5522050 0 112.453353 0 120.881891 0 16 9 26 3.0 1.0 27 C24 C22 C12 C23 H 1.0213304 0 106.860384 0 -120.649920 0 16 9 26 6.0 1.0 60 H27 C22 C12 C23 N 1.1448596 0 177.942424 0 29.902237 0 17 9 3 3.0 1.0 29 N2 C25 C12 C11 C 1.5386878 0 107.833899 0 -172.394400 1 18 12 6 3.0 1.0 1 C1 C7 C8 N1 H 1.0159191 0 107.089714 0 -117.547826 0 18 12 30 6.0 1.0 37 H4 C7 C8 C1 H 0.9772984 0 110.133242 0 121.294519 0 18 12 30 6.0 1.0 38 H5 C7 C8 C1 C 1.4111676 0 119.807188 0 178.232553 0 24 15 9 3.0 1.0 16 C15 C14 C13 C12 H 0.9858277 0 121.051344 0 -178.596858 0 24 15 33 6.0 1.0 48 H15 C14 C13 C15 C 1.3823798 0 118.308573 0 -177.431840 0 25 15 9 3.0 1.0 18 C17 C18 C13 C12 H 0.9931700 0 115.152768 0 -172.450146 0 25 15 35 6.0 1.0 50 H17 C18 C13 C17 H 0.9876474 0 105.703129 0 64.447066 0 26 16 9 6.0 1.0 61 H28 C23 C22 C12 H 1.0075928 0 114.207261 0 121.663055 0 26 16 37 6.0 1.0 62 H29 C23 C22 H28 H 1.0389676 0 109.474563 0 -122.246034 0 26 16 37 6.0 1.0 63 H30 C23 C22 H28 H 0.9006730 0 108.883433 0 -66.659105 0 27 16 9 6.0 1.0 64 H31 C24 C22 C12 H 1.0366766 0 108.571153 0 122.556261 0 27 16 40 6.0 1.0 65 H32 C24 C22 H31 H 1.0307114 0 109.994234 0 -120.116344 0 27 16 40 6.0 1.0 66 H33 C24 C22 H31 C 1.4055169 0 119.334955 0 94.003065 1 30 18 12 3.0 1.0 2 C2 C1 C7 C8 C 1.4073815 0 120.046354 0 179.545487 0 30 18 43 3.0 1.0 6 C6 C1 C7 C2 C 1.3821418 0 119.697205 0 -1.247091 0 33 24 15 3.0 1.0 17 C16 C15 C14 C13 H 1.0158291 0 120.913810 0 178.050307 0 33 24 45 6.0 1.0 49 H16 C15 C14 C16 O 1.3775333 0 123.875127 0 178.248265 0 35 25 15 3.0 1.0 32 O4 C17 C18 C13 C 1.4033056 0 120.206510 0 175.737282 0 43 30 18 3.0 1.0 3 C3 C2 C1 C7 H 1.0162809 0 118.511977 0 179.008987 0 43 30 48 6.0 1.0 34 H1 C2 C1 C3 C 1.3620420 0 118.301976 0 -175.630491 0 44 30 18 3.0 1.0 5 C5 C6 C1 C7 H 1.0534708 0 120.211544 0 176.973803 0 44 30 50 6.0 1.0 36 H3 C6 C1 C5 O 1.3817296 0 124.490661 0 -179.481038 0 45 33 24 3.0 1.0 30 O3 C16 C15 C14 C 1.4553180 0 117.926364 0 -5.691737 1 47 35 25 3.0 1.0 33 C27 O4 C17 C18 C 1.3853769 0 119.466565 0 -0.013908 0 48 43 30 3.0 1.0 4 C4 C3 C2 C1 H 1.0135151 0 117.532361 0 -179.723078 0 48 43 54 6.0 1.0 35 H2 C3 C2 C4 O 1.3846533 0 124.157053 0 -179.872052 0 50 44 30 3.0 1.0 22 O2 C5 C6 C1 C 1.4459162 0 116.671677 0 -3.961557 1 52 45 33 3.0 1.0 31 C26 O3 C16 C15 H 1.0059274 0 105.867806 0 -58.617207 0 53 47 35 6.0 1.0 70 H37 C27 O4 C17 H 1.0128741 0 108.966925 0 120.565880 0 53 47 58 6.0 1.0 71 H38 C27 O4 H37 H 1.0204625 0 107.736962 0 -120.891976 0 53 47 58 6.0 1.0 72 H39 C27 O4 H37 O 1.3739448 0 124.498521 0 -175.276650 0 54 48 43 3.0 1.0 20 O1 C4 C3 C2 C 1.4397229 0 117.418922 0 4.643547 1 56 50 44 3.0 1.0 23 C20 O2 C5 C6 H 0.9208879 0 97.277655 0 71.787675 0 57 52 45 6.0 1.0 67 H34 C26 O3 C16 H 1.0253523 0 112.067913 0 118.497254 0 57 52 63 6.0 1.0 68 H35 C26 O3 H34 H 1.0052974 0 111.918617 0 -121.781059 0 57 52 63 6.0 1.0 69 H36 C26 O3 H34 C 1.4478893 0 116.334329 0 8.589873 1 61 54 48 3.0 1.0 21 C19 O1 C4 C3 H 0.8140670 0 104.445676 0 -105.230781 0 62 56 50 6.0 1.0 54 H21 C20 O2 C5 H 1.0085734 0 111.523751 0 122.199813 0 62 56 67 6.0 1.0 55 H22 C20 O2 H21 H 1.0224894 0 108.579220 0 -117.271394 0 62 56 67 6.0 1.0 56 H23 C20 O2 H21 H 1.0362238 0 108.933121 0 157.364130 0 66 61 54 6.0 1.0 51 H18 C19 O1 C4 H 1.0309202 0 108.006741 0 118.473507 0 66 61 70 6.0 1.0 52 H19 C19 O1 H18 H 1.0432767 0 114.838513 0 -125.528451 0 66 61 70 6.0 1.0 53 H20 C19 O1 H18