@MOLECULE (1beta,1'beta)-6,6',7,12-tetramethoxy-2,2'-dimethylberbaman 88 94 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.2046 -0.9884 -0.5684 O.3 1 UNL1111111111 -0.2740 2 O 2.4112 -2.8348 -0.4949 O.3 1 UNL1111111111 -0.3124 3 O 1.7303 -5.6442 -0.3989 O.3 1 UNL1111111111 -0.3148 4 O 0.9420 -1.7174 1.9451 O.3 1 UNL1111111111 -0.2828 5 O -2.5909 3.4787 -0.7532 O.3 1 UNL1111111111 -0.3190 6 O -5.1314 3.8736 0.5981 O.3 1 UNL1111111111 -0.3066 7 N -3.6198 -2.4013 -1.0836 N.3 1 UNL1111111111 -0.4211 8 N 5.1424 2.3459 -0.5557 N.3 1 UNL1111111111 -0.4141 9 C -2.3976 -1.7636 -0.5482 C.3 1 UNL1111111111 0.1032 10 C 3.6848 2.3741 -0.8208 C.3 1 UNL1111111111 0.0715 11 C -1.2836 -2.7825 -0.5049 C.ar 1 UNL1111111111 -0.1703 12 C -3.9997 -3.6024 -0.3101 C.3 1 UNL1111111111 -0.1022 13 C -1.5434 -4.1541 -0.4926 C.ar 1 UNL1111111111 0.1099 14 C -2.9397 -4.6835 -0.5848 C.3 1 UNL1111111111 -0.2857 15 C 3.0397 1.2304 -0.0746 C.ar 1 UNL1111111111 -0.0710 16 C -2.5327 -1.1337 0.8728 C.3 1 UNL1111111111 -0.3372 17 C 5.4407 2.4759 0.8878 C.3 1 UNL1111111111 -0.1051 18 C 3.5464 0.7855 1.1451 C.ar 1 UNL1111111111 0.0521 19 C 4.8658 1.2690 1.6570 C.3 1 UNL1111111111 -0.2875 20 C 3.0231 3.7335 -0.4415 C.3 1 UNL1111111111 -0.3424 21 C 0.0514 -2.3520 -0.4900 C.ar 1 UNL1111111111 0.2185 22 C 1.9345 0.5909 -0.6463 C.ar 1 UNL1111111111 -0.1651 23 C -4.7487 -1.4653 -1.2249 C.3 1 UNL1111111111 -0.2707 24 C -0.5015 -5.0799 -0.4290 C.ar 1 UNL1111111111 -0.3244 25 C 1.3139 -0.4387 0.0459 C.ar 1 UNL1111111111 0.1204 26 C -3.1849 0.2074 0.8198 C.ar 1 UNL1111111111 0.0131 27 C 2.8662 -0.1959 1.8809 C.ar 1 UNL1111111111 -0.3014 28 C 1.1104 -3.2658 -0.5021 C.ar 1 UNL1111111111 -0.0472 29 C 5.8697 3.3661 -1.3393 C.3 1 UNL1111111111 -0.2789 30 C 1.5349 3.6835 -0.5239 C.ar 1 UNL1111111111 -0.0159 31 C 0.8229 -4.6352 -0.4296 C.ar 1 UNL1111111111 0.2385 32 C 1.7315 -0.7905 1.3453 C.ar 1 UNL1111111111 0.1959 33 C -2.5718 1.2232 0.0895 C.ar 1 UNL1111111111 -0.2112 34 C -4.3865 0.4692 1.4863 C.ar 1 UNL1111111111 -0.1669 35 C 0.7972 3.5379 0.6560 C.ar 1 UNL1111111111 -0.1181 36 C 0.8832 3.7778 -1.7554 C.ar 1 UNL1111111111 -0.1399 37 C -3.1696 2.4772 0.0029 C.ar 1 UNL1111111111 0.0933 38 C -4.9953 1.7142 1.3850 C.ar 1 UNL1111111111 -0.2058 39 C -1.2144 3.5267 -0.6352 C.ar 1 UNL1111111111 0.2033 40 C -0.5878 3.4611 0.6102 C.ar 1 UNL1111111111 -0.2174 41 C -0.5061 3.6947 -1.8231 C.ar 1 UNL1111111111 -0.2032 42 C -4.3966 2.7320 0.6268 C.ar 1 UNL1111111111 0.1606 43 C 2.8659 -2.4671 -1.7973 C.3 1 UNL1111111111 -0.2100 44 C 3.0447 -5.3352 0.0511 C.3 1 UNL1111111111 -0.1871 45 C 1.3159 -2.1092 3.2583 C.3 1 UNL1111111111 -0.2074 46 C -4.6070 4.9734 -0.1342 C.3 1 UNL1111111111 -0.1944 47 H -2.1246 -0.9565 -1.2893 H 1 UNL1111111111 0.1629 48 H 3.5565 2.2132 -1.9256 H 1 UNL1111111111 0.1465 49 H -4.9954 -3.9561 -0.6520 H 1 UNL1111111111 0.1299 50 H -4.0856 -3.4135 0.7815 H 1 UNL1111111111 0.1146 51 H -3.0902 -5.0827 -1.6147 H 1 UNL1111111111 0.1680 52 H -3.0884 -5.5377 0.1029 H 1 UNL1111111111 0.1456 53 H -1.5145 -1.0327 1.3167 H 1 UNL1111111111 0.1815 54 H -3.0656 -1.8326 1.5408 H 1 UNL1111111111 0.1484 55 H 5.0573 3.4214 1.3277 H 1 UNL1111111111 0.1130 56 H 6.5455 2.4944 1.0125 H 1 UNL1111111111 0.1337 57 H 4.8061 1.5188 2.7344 H 1 UNL1111111111 0.1460 58 H 5.5857 0.4213 1.5751 H 1 UNL1111111111 0.1634 59 H 3.4234 4.5258 -1.1026 H 1 UNL1111111111 0.1477 60 H 3.3397 4.0183 0.5836 H 1 UNL1111111111 0.1542 61 H 1.5567 0.8914 -1.6235 H 1 UNL1111111111 0.1768 62 H -4.4015 -0.5342 -1.7052 H 1 UNL1111111111 0.1530 63 H -5.2438 -1.1951 -0.2802 H 1 UNL1111111111 0.1257 64 H -5.4950 -1.9207 -1.8968 H 1 UNL1111111111 0.1386 65 H -0.7030 -6.1468 -0.3897 H 1 UNL1111111111 0.1764 66 H 3.2485 -0.4936 2.8510 H 1 UNL1111111111 0.1629 67 H 6.9504 3.1539 -1.2682 H 1 UNL1111111111 0.1456 68 H 5.7002 4.4056 -1.0221 H 1 UNL1111111111 0.1190 69 H 5.5971 3.2756 -2.4038 H 1 UNL1111111111 0.1466 70 H -1.6174 1.0366 -0.4099 H 1 UNL1111111111 0.1874 71 H -4.8528 -0.3063 2.0895 H 1 UNL1111111111 0.1523 72 H 1.3118 3.4659 1.6127 H 1 UNL1111111111 0.1548 73 H 1.4602 3.9063 -2.6679 H 1 UNL1111111111 0.1485 74 H -5.9377 1.9197 1.8892 H 1 UNL1111111111 0.1680 75 H -1.1735 3.3332 1.5179 H 1 UNL1111111111 0.1722 76 H -1.0305 3.7471 -2.7726 H 1 UNL1111111111 0.1669 77 H 3.8857 -2.1070 -1.6019 H 1 UNL1111111111 0.1476 78 H 2.8705 -3.3267 -2.4720 H 1 UNL1111111111 0.1256 79 H 2.2405 -1.6620 -2.1987 H 1 UNL1111111111 0.1432 80 H 3.6225 -4.8915 -0.7652 H 1 UNL1111111111 0.1392 81 H 3.4339 -6.3256 0.3187 H 1 UNL1111111111 0.1377 82 H 3.0338 -4.6727 0.9220 H 1 UNL1111111111 0.1417 83 H 2.2994 -2.5882 3.2607 H 1 UNL1111111111 0.1311 84 H 0.5353 -2.8374 3.5159 H 1 UNL1111111111 0.1543 85 H 1.2887 -1.2549 3.9416 H 1 UNL1111111111 0.1337 86 H -5.3964 5.7264 -0.0148 H 1 UNL1111111111 0.1430 87 H -3.6671 5.3216 0.3053 H 1 UNL1111111111 0.1407 88 H -4.4767 4.7153 -1.1910 H 1 UNL1111111111 0.1431 @BOND 1 1 21 1 2 1 25 1 3 2 28 1 4 2 43 1 5 3 31 1 6 3 44 1 7 4 32 1 8 4 45 1 9 5 37 1 10 5 39 1 11 6 42 1 12 6 46 1 13 7 9 1 14 7 12 1 15 7 23 1 16 8 10 1 17 8 17 1 18 8 29 1 19 9 11 1 20 9 16 1 21 9 47 1 22 10 15 1 23 10 20 1 24 10 48 1 25 11 13 ar 26 11 21 ar 27 12 14 1 28 12 49 1 29 12 50 1 30 13 14 1 31 13 24 ar 32 14 51 1 33 14 52 1 34 15 18 ar 35 15 22 ar 36 16 26 1 37 16 53 1 38 16 54 1 39 17 19 1 40 17 55 1 41 17 56 1 42 18 19 1 43 18 27 ar 44 19 57 1 45 19 58 1 46 20 30 1 47 20 59 1 48 20 60 1 49 21 28 ar 50 22 25 ar 51 22 61 1 52 23 62 1 53 23 63 1 54 23 64 1 55 24 31 ar 56 24 65 1 57 25 32 ar 58 26 33 ar 59 26 34 ar 60 27 32 ar 61 27 66 1 62 28 31 ar 63 29 67 1 64 29 68 1 65 29 69 1 66 30 35 ar 67 30 36 ar 68 33 37 ar 69 33 70 1 70 34 38 ar 71 34 71 1 72 35 40 ar 73 35 72 1 74 36 41 ar 75 36 73 1 76 37 42 ar 77 38 42 ar 78 38 74 1 79 39 40 ar 80 39 41 ar 81 40 75 1 82 41 76 1 83 43 77 1 84 43 78 1 85 43 79 1 86 44 80 1 87 44 81 1 88 44 82 1 89 45 83 1 90 45 84 1 91 45 85 1 92 46 86 1 93 46 87 1 94 46 88 1