8182 DSViewer 3D 0 38 37 0 0 0 0 0 0 0 0999 V2000 6.1367 -0.4460 0.0002 C 0 0 0 0 0 0 0 0 0 1 7.3895 0.4463 0.0000 C 0 0 0 0 0 0 0 0 0 2 4.8789 0.4392 0.0003 C 0 0 0 0 0 0 0 0 0 3 8.6474 -0.4389 -0.0000 C 0 0 0 0 0 0 0 0 0 4 3.6260 -0.4530 0.0004 C 0 0 0 0 0 0 0 0 0 5 9.9002 0.4534 -0.0001 C 0 0 0 0 0 0 0 0 0 6 2.3680 0.4324 0.0006 C 0 0 0 0 0 0 0 0 0 7 11.1583 -0.4318 -0.0001 C 0 0 0 0 0 0 0 0 0 8 12.4122 0.4605 -0.0002 C 0 0 0 0 0 0 0 0 0 9 1.1140 -0.4597 0.0008 C 0 0 0 0 0 0 0 0 0 10 -0.1452 0.4258 0.0010 C 0 0 0 0 0 0 0 0 0 11 13.6715 -0.4249 -0.0002 C 0 0 0 0 0 0 0 0 0 12 6.1384 -1.0751 -0.8900 H 0 0 0 0 0 0 0 0 0 13 6.1386 -1.0751 0.8903 H 0 0 0 0 0 0 0 0 0 14 7.3877 1.0753 -0.8902 H 0 0 0 0 0 0 0 0 0 15 7.3878 1.0754 0.8901 H 0 0 0 0 0 0 0 0 0 16 8.6493 -1.0679 0.8901 H 0 0 0 0 0 0 0 0 0 17 8.6492 -1.0680 -0.8902 H 0 0 0 0 0 0 0 0 0 18 4.8772 1.0683 0.8904 H 0 0 0 0 0 0 0 0 0 19 4.8770 1.0683 -0.8899 H 0 0 0 0 0 0 0 0 0 20 3.6276 -1.0821 -0.8897 H 0 0 0 0 0 0 0 0 0 21 3.6278 -1.0821 0.8906 H 0 0 0 0 0 0 0 0 0 22 9.8984 1.0825 -0.8903 H 0 0 0 0 0 0 0 0 0 23 9.8984 1.0826 0.8900 H 0 0 0 0 0 0 0 0 0 24 2.3665 1.0615 0.8907 H 0 0 0 0 0 0 0 0 0 25 2.3662 1.0614 -0.8896 H 0 0 0 0 0 0 0 0 0 26 11.1600 -1.0608 0.8900 H 0 0 0 0 0 0 0 0 0 27 11.1600 -1.0609 -0.8902 H 0 0 0 0 0 0 0 0 0 28 12.4104 1.0895 -0.8903 H 0 0 0 0 0 0 0 0 0 29 12.4104 1.0896 0.8899 H 0 0 0 0 0 0 0 0 0 30 1.1156 -1.0888 -0.8893 H 0 0 0 0 0 0 0 0 0 31 1.1158 -1.0888 0.8910 H 0 0 0 0 0 0 0 0 0 32 -1.0339 -0.2053 0.0011 H 0 0 0 0 0 0 0 0 0 33 -0.1474 1.0553 -0.8889 H 0 0 0 0 0 0 0 0 0 34 -0.1472 1.0554 0.8908 H 0 0 0 0 0 0 0 0 0 35 14.5601 0.2064 -0.0002 H 0 0 0 0 0 0 0 0 0 36 13.6737 -1.0544 -0.8900 H 0 0 0 0 0 0 0 0 0 37 13.6737 -1.0543 0.8897 H 0 0 0 0 0 0 0 0 0 38 1 2 1 0 0 0 1 3 1 0 0 0 1 13 1 0 0 0 1 14 1 0 0 0 2 4 1 0 0 0 2 15 1 0 0 0 2 16 1 0 0 0 3 5 1 0 0 0 3 19 1 0 0 0 3 20 1 0 0 0 4 6 1 0 0 0 4 17 1 0 0 0 4 18 1 0 0 0 5 7 1 0 0 0 5 21 1 0 0 0 5 22 1 0 0 0 6 8 1 0 0 0 6 23 1 0 0 0 6 24 1 0 0 0 7 10 1 0 0 0 7 25 1 0 0 0 7 26 1 0 0 0 8 9 1 0 0 0 8 27 1 0 0 0 8 28 1 0 0 0 9 12 1 0 0 0 9 29 1 0 0 0 9 30 1 0 0 0 10 11 1 0 0 0 10 31 1 0 0 0 10 32 1 0 0 0 11 33 1 0 0 0 11 34 1 0 0 0 11 35 1 0 0 0 12 36 1 0 0 0 12 37 1 0 0 0 12 38 1 0 0 0 M END > 8182 > 1 > 56.4 > 0 > 0 > 9 > AAADceBwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGAAAAAAACACAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAEAgIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > dodecane > dodecane > dodecane > dodecane > dodecane > InChI=1S/C12H26/c1-3-5-7-9-11-12-10-8-6-4-2/h3-12H2,1-2H3 > SNRUBQQJIBEYMU-UHFFFAOYSA-N > 6.1 > 170.203 > C12H26 > 170.335 > CCCCCCCCCCCC > CCCCCCCCCCCC > 0 > 170.203 > 0 > 12 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 1 5 255 $$$$