@MOLECULE (Z,6S)-2,2,6-trimethyloct-4-ene 33 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.0243 1.9310 0.0993 C.3 1 UNL11111111 -0.7607 2 C 2.3396 0.8091 -0.6794 C.3 1 UNL11111111 -0.3003 3 C 1.9760 -0.3816 0.2339 C.3 1 UNL11111111 0.3362 4 H 1.4965 0.0160 1.1628 H 1 UNL11111111 0.1282 5 C 3.2226 -1.1789 0.6420 C.3 1 UNL11111111 -0.9927 6 C 1.0264 -1.2760 -0.5075 C.2 1 UNL11111111 -0.5494 7 C -0.2935 -1.3417 -0.3097 C.2 1 UNL11111111 -0.0166 8 C -1.0603 -0.5517 0.6985 C.3 1 UNL11111111 -0.6322 9 C -2.2587 0.2127 0.0814 C.3 1 UNL11111111 0.7558 10 C -3.3410 -0.7713 -0.3880 C.3 1 UNL11111111 -1.0121 11 C -2.8516 1.1318 1.1657 C.3 1 UNL11111111 -1.0425 12 C -1.7866 1.0704 -1.1012 C.3 1 UNL11111111 -0.9883 13 H 3.2595 2.7789 -0.5534 H 1 UNL11111111 0.2099 14 H 2.3876 2.3045 0.9088 H 1 UNL11111111 0.2183 15 H 3.9643 1.5914 0.5482 H 1 UNL11111111 0.2358 16 H 1.4186 1.1958 -1.1586 H 1 UNL11111111 0.1363 17 H 2.9871 0.4657 -1.5065 H 1 UNL11111111 0.1652 18 H 3.9040 -0.5675 1.2426 H 1 UNL11111111 0.2567 19 H 2.9480 -2.0550 1.2402 H 1 UNL11111111 0.2914 20 H 3.7796 -1.5343 -0.2308 H 1 UNL11111111 0.2806 21 H 1.5036 -1.8964 -1.2665 H 1 UNL11111111 0.2365 22 H -0.9061 -2.0241 -0.9017 H 1 UNL11111111 0.1531 23 H -1.4281 -1.2349 1.4924 H 1 UNL11111111 0.2446 24 H -0.4064 0.1761 1.2205 H 1 UNL11111111 0.2162 25 H -3.6886 -1.4047 0.4343 H 1 UNL11111111 0.2805 26 H -4.2115 -0.2406 -0.7874 H 1 UNL11111111 0.2629 27 H -2.9704 -1.4308 -1.1794 H 1 UNL11111111 0.2775 28 H -2.1188 1.8685 1.5100 H 1 UNL11111111 0.2666 29 H -3.7160 1.6851 0.7849 H 1 UNL11111111 0.2743 30 H -3.1847 0.5595 2.0369 H 1 UNL11111111 0.2850 31 H -1.3927 0.4471 -1.9116 H 1 UNL11111111 0.2549 32 H -2.6046 1.6708 -1.5107 H 1 UNL11111111 0.2512 33 H -0.9869 1.7557 -0.8010 H 1 UNL11111111 0.2768 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 2 7 7 8 1 8 8 9 1 9 9 10 1 10 9 11 1 11 9 12 1 12 1 13 1 13 1 14 1 14 1 15 1 15 2 16 1 16 2 17 1 17 5 18 1 18 5 19 1 19 5 20 1 20 6 21 1 21 7 22 1 22 8 23 1 23 8 24 1 24 10 25 1 25 10 26 1 26 10 27 1 27 11 28 1 28 11 29 1 29 11 30 1 30 12 31 1 31 12 32 1 32 12 33 1