@MOLECULE (Z)-4,8,8-trimethylnon-4-ene 36 35 0 0 0 SMALL USER_CHARGES @ATOM 1 C 2.1345 1.5818 0.5012 C.3 1 UNL11111111 -0.9301 2 C 2.6215 0.1778 0.1085 C.3 1 UNL11111111 0.7077 3 C 3.2131 0.2125 -1.3085 C.3 1 UNL11111111 -0.9024 4 C 3.7197 -0.2617 1.0969 C.3 1 UNL11111111 -1.0453 5 C 1.4628 -0.8404 0.1976 C.3 1 UNL11111111 -0.5340 6 C 0.3429 -0.5933 -0.8259 C.3 1 UNL11111111 -0.2545 7 C -0.8143 -1.4887 -0.5221 C.2 1 UNL11111111 -0.5139 8 C -1.9231 -1.1118 0.1272 C.2 1 UNL11111111 0.3306 9 C -3.0302 -2.0809 0.3935 C.3 1 UNL11111111 -0.9782 10 C -2.1638 0.2782 0.6358 C.3 1 UNL11111111 -0.5179 11 C -2.7809 1.1495 -0.4711 C.3 1 UNL11111111 -0.0391 12 C -2.9621 2.5898 0.0052 C.3 1 UNL11111111 -0.7720 13 H 1.3927 1.9641 -0.2074 H 1 UNL11111111 0.2342 14 H 1.6709 1.5780 1.4928 H 1 UNL11111111 0.2611 15 H 2.9633 2.2965 0.5244 H 1 UNL11111111 0.2390 16 H 4.1007 0.8521 -1.3511 H 1 UNL11111111 0.2355 17 H 3.5088 -0.7878 -1.6408 H 1 UNL11111111 0.2488 18 H 2.4941 0.6045 -2.0351 H 1 UNL11111111 0.2142 19 H 3.3361 -0.3155 2.1202 H 1 UNL11111111 0.2782 20 H 4.1177 -1.2478 0.8383 H 1 UNL11111111 0.2744 21 H 4.5584 0.4412 1.0964 H 1 UNL11111111 0.2795 22 H 1.8591 -1.8641 0.0628 H 1 UNL11111111 0.2160 23 H 1.0356 -0.8163 1.2185 H 1 UNL11111111 0.2149 24 H 0.0451 0.4733 -0.8196 H 1 UNL11111111 0.2016 25 H 0.7145 -0.7870 -1.8520 H 1 UNL11111111 0.1598 26 H -0.6846 -2.5135 -0.8652 H 1 UNL11111111 0.2676 27 H -3.1497 -2.2572 1.4719 H 1 UNL11111111 0.2997 28 H -3.9895 -1.6998 0.0157 H 1 UNL11111111 0.2777 29 H -2.8616 -3.0581 -0.0765 H 1 UNL11111111 0.2733 30 H -2.8302 0.2661 1.5202 H 1 UNL11111111 0.2229 31 H -1.2181 0.7339 0.9933 H 1 UNL11111111 0.1969 32 H -2.1375 1.1228 -1.3716 H 1 UNL11111111 0.0850 33 H -3.7535 0.7256 -0.7842 H 1 UNL11111111 0.1209 34 H -3.6226 2.6434 0.8777 H 1 UNL11111111 0.2279 35 H -2.0053 3.0427 0.2880 H 1 UNL11111111 0.2228 36 H -3.4020 3.2144 -0.7801 H 1 UNL11111111 0.1971 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 6 1 6 6 7 1 7 7 8 2 8 8 9 1 9 8 10 1 10 10 11 1 11 11 12 1 12 1 13 1 13 1 14 1 14 1 15 1 15 3 16 1 16 3 17 1 17 3 18 1 18 4 19 1 19 4 20 1 20 4 21 1 21 5 22 1 22 5 23 1 23 6 24 1 24 6 25 1 25 7 26 1 26 9 27 1 27 9 28 1 28 9 29 1 29 10 30 1 30 10 31 1 31 11 32 1 32 11 33 1 33 12 34 1 34 12 35 1 35 12 36 1