@MOLECULE (2e,6e)-3,11-dimethyl-2,6,10-dodecatrien-1-yl trihydrogen diphosphate 49 48 0 0 0 SMALL GASTEIGER @ATOM 1 P 1.7501 -0.6436 1.1985 P.3 1 UNL1111111111 0.3677 2 P 4.1297 0.2258 -0.6134 P.3 1 UNL1111111111 0.3869 3 O 0.6612 0.5004 1.1532 O.3 1 UNL1111111111 -0.1433 4 O 2.9394 -0.1018 0.3429 O.3 1 UNL1111111111 -0.3592 5 O 1.1246 -1.7859 0.2729 O.3 1 UNL1111111111 -0.3679 6 O 2.1268 -0.9825 2.5579 O.2 1 UNL1111111111 -0.2359 7 O 5.2187 0.8071 0.3773 O.3 1 UNL1111111111 -0.2524 8 O 4.7449 -1.2074 -0.9520 O.3 1 UNL1111111111 -0.3684 9 O 3.7870 1.1088 -1.7077 O.2 1 UNL1111111111 -0.2273 10 C -2.8821 3.3938 0.0070 C.3 1 UNL1111111111 -0.2838 11 C -4.1851 2.5740 -0.0255 C.3 1 UNL1111111111 -0.2666 12 C -1.7261 2.5797 -0.4978 C.2 1 UNL1111111111 0.0329 13 C -4.2182 -0.9493 1.5993 C.3 1 UNL1111111111 -0.2732 14 C -4.1304 1.4556 0.9657 C.2 1 UNL1111111111 -0.1798 15 C -3.1190 -1.9450 1.1779 C.3 1 UNL1111111111 -0.2592 16 C -4.2973 0.1766 0.6206 C.2 1 UNL1111111111 -0.1505 17 C -0.9115 1.9390 0.3494 C.2 1 UNL1111111111 -0.2476 18 C -1.5396 2.5422 -1.9779 C.3 1 UNL1111111111 -0.4614 19 C -3.4959 -2.6398 -0.0893 C.2 1 UNL1111111111 -0.2331 20 C 0.2875 1.1650 -0.0941 C.3 1 UNL1111111111 -0.0310 21 C -2.9328 -2.4108 -1.2830 C.2 1 UNL1111111111 0.0500 22 C -3.3782 -3.1503 -2.5044 C.3 1 UNL1111111111 -0.4596 23 C -1.8339 -1.4269 -1.5028 C.3 1 UNL1111111111 -0.4698 24 H -2.6930 3.7534 1.0387 H 1 UNL1111111111 0.1467 25 H -3.0034 4.3114 -0.6018 H 1 UNL1111111111 0.1417 26 H -4.3642 2.1988 -1.0524 H 1 UNL1111111111 0.1440 27 H -5.0468 3.2343 0.2043 H 1 UNL1111111111 0.1429 28 H -4.0104 -0.5849 2.6245 H 1 UNL1111111111 0.1407 29 H -5.1973 -1.4679 1.6555 H 1 UNL1111111111 0.1457 30 H -3.9315 1.7597 1.9897 H 1 UNL1111111111 0.1439 31 H -2.9609 -2.6892 1.9844 H 1 UNL1111111111 0.1399 32 H -2.1508 -1.4095 1.0859 H 1 UNL1111111111 0.1632 33 H -4.4874 -0.1302 -0.4074 H 1 UNL1111111111 0.1485 34 H -1.0751 1.9533 1.4287 H 1 UNL1111111111 0.1705 35 H -0.6287 3.0824 -2.2764 H 1 UNL1111111111 0.1599 36 H -2.3783 2.9940 -2.5228 H 1 UNL1111111111 0.1509 37 H -1.4410 1.5099 -2.3469 H 1 UNL1111111111 0.1572 38 H -4.3002 -3.3635 0.0232 H 1 UNL1111111111 0.1409 39 H 0.0600 0.4678 -0.9252 H 1 UNL1111111111 0.1422 40 H 1.1003 1.8567 -0.4155 H 1 UNL1111111111 0.1600 41 H -3.8283 -2.4649 -3.2362 H 1 UNL1111111111 0.1542 42 H -4.1251 -3.9234 -2.2844 H 1 UNL1111111111 0.1489 43 H -2.5323 -3.6489 -2.9969 H 1 UNL1111111111 0.1515 44 H -0.8798 -1.8140 -1.1051 H 1 UNL1111111111 0.1789 45 H -2.0338 -0.4771 -0.9789 H 1 UNL1111111111 0.1685 46 H -1.6756 -1.1912 -2.5601 H 1 UNL1111111111 0.1416 47 H 1.6479 -2.6505 0.4221 H 1 UNL1111111111 0.3146 48 H 5.2325 0.2091 1.2236 H 1 UNL1111111111 0.3197 49 H 4.1291 -1.6769 -1.6186 H 1 UNL1111111111 0.3157 @BOND 1 1 3 1 2 1 4 1 3 1 5 1 4 1 6 2 5 2 4 1 6 2 7 1 7 2 8 1 8 2 9 2 9 3 20 1 10 5 47 1 11 7 48 1 12 8 49 1 13 10 11 1 14 10 12 1 15 10 24 1 16 10 25 1 17 11 14 1 18 11 26 1 19 11 27 1 20 12 17 2 21 12 18 1 22 13 15 1 23 13 16 1 24 13 28 1 25 13 29 1 26 14 16 2 27 14 30 1 28 15 19 1 29 15 31 1 30 15 32 1 31 16 33 1 32 17 20 1 33 17 34 1 34 18 35 1 35 18 36 1 36 18 37 1 37 19 21 2 38 19 38 1 39 20 39 1 40 20 40 1 41 21 22 1 42 21 23 1 43 22 41 1 44 22 42 1 45 22 43 1 46 23 44 1 47 23 45 1 48 23 46 1