PC(16:0/18:1(9Z)) Mrv1652309042000332D 53 52 0 0 0 0 999 V2000 -3.8021 0.3608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9591 0.3596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2447 0.7720 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.6571 1.4866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1679 0.0575 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.0969 0.7716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3824 0.3590 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6679 0.7716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9699 -0.3555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -0.3555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4699 1.1846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1844 0.7721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8988 1.1846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6132 0.7721 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2007 0.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2744 1.6358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3277 0.3596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5121 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5121 1.5410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2263 0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9404 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6545 0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3686 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0827 0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7969 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5110 0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2251 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9392 0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6534 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3675 0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0816 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7957 0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5098 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2240 0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5095 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5095 -1.5394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2237 -0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9378 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6519 -0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3660 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0801 -0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7943 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5084 -0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2225 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0475 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7616 -0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4758 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1899 -0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9040 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6181 -0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3322 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0464 -0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7605 -0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 0 0 0 0 4 3 2 0 0 0 0 5 3 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 7 9 1 1 0 0 0 6 1 1 0 0 0 0 2 8 1 0 0 0 0 7 10 1 6 0 0 0 1 18 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 11 3 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 2 5 -1 14 1 M END