No title 1.00000000000000 30.0000000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 20.0000000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 15.0000000000000000 C Si O N H 6 10 8 6 42 Direct 0.2235872400000005 0.5293257399999973 0.3248160200000001 0.2717281299999996 0.3886610699999977 0.2987643499999990 0.1435853300000005 0.4549715899999995 0.2415283099999996 0.6734140200000027 0.6604553199999970 0.4714501899999988 0.6295173299999988 0.6038972300000012 0.6644209899999964 0.5892224099999979 0.7846154699999985 0.4653449799999976 0.2713510000000028 0.4800143399999968 0.2916645500000001 0.1793699199999992 0.5313965100000004 0.2495680099999973 0.3615783099999987 0.5492435999999969 0.3787565700000002 0.4099041699999972 0.4425915899999993 0.2748148599999993 0.3792632199999986 0.4168439700000022 0.5039266100000006 0.6412705799999969 0.5975144000000014 0.4833937499999976 0.6423250300000021 0.7368039300000007 0.4178728400000011 0.6366216099999988 0.4243849100000006 0.4399768299999991 0.5653201699999997 0.3285240399999978 0.3505402600000025 0.5576528900000000 0.3631877400000008 0.5507130399999980 0.2735079500000026 0.4638615699999988 0.1620134899999996 0.3111080600000022 0.5218285400000013 0.3505497599999998 0.1982883499999986 0.5660873599999974 0.1581978099999972 0.1448352099999966 0.5764604499999990 0.3145793099999992 0.5509402499999965 0.6064782199999996 0.3758629700000000 0.6534522899999970 0.5117951800000000 0.4648261000000034 0.6583845899999972 0.7086416499999970 0.3073442999999969 0.6809081000000035 0.7987802900000034 0.4372857999999979 0.3833786200000020 0.4733062199999978 0.4147367400000022 0.3437674500000014 0.4490719599999977 0.5871161000000029 0.3433317699999989 0.5830162700000017 0.1396979499999986 0.5828069200000030 0.3832521200000016 0.4515190999999987 0.5942218900000000 0.3841974799999974 0.6393604100000019 0.5936962999999977 0.2645153899999997 0.2994454600000012 0.2121833799999990 0.5004790400000019 0.3817589200000029 0.2390039900000005 0.5791666100000015 0.3421069999999986 0.2626528899999983 0.5413272600000028 0.1476077900000021 0.2633360800000020 0.3538827599999976 0.3531137499999986 0.3012841999999978 0.3607117000000031 0.2761131999999975 0.2451846499999988 0.3801991799999982 0.2497911700000017 0.1184763700000033 0.4715994000000023 0.1898967999999996 0.1247436299999976 0.4460717799999969 0.3068074500000009 0.1605794600000010 0.4077894899999990 0.2201313899999988 0.1731925099999998 0.5918400899999980 0.1206017399999979 0.1109557799999976 0.5591158100000015 0.3252706700000019 0.3813107100000011 0.5658183999999977 0.3039918500000027 0.3647775199999970 0.5983573199999981 0.4415305300000014 0.4779742200000001 0.4631733000000011 0.3803364400000007 0.4368337599999990 0.3758229999999969 0.2172040199999969 0.3512312499999979 0.3664613799999970 0.4539199499999995 0.4249287399999986 0.3827686200000002 0.5229369799999972 0.3160247699999985 0.4690599700000035 0.5645736299999982 0.3565872799999994 0.4934980900000028 0.6220542300000034 0.4793196299999991 0.5142290599999981 0.2953923099999969 0.3119021500000017 0.5990396500000017 0.2113008800000031 0.6495983000000010 0.6454009999999997 0.5389829599999985 0.7097046499999990 0.6619104600000014 0.4640159599999976 0.5950029199999989 0.6098267100000001 0.3025418000000002 0.6019297200000011 0.6349027300000003 0.7454459799999995 0.6888493800000006 0.4700946900000034 0.6378816100000009 0.5638571100000007 0.5994706399999998 0.5361696699999996 0.5870452599999965 0.8368054199999975 0.4354887399999967 0.5915363499999984 0.7916423200000011 0.5409342800000019 0.5532986699999967 0.7672954700000005 0.4606430199999991 0.6433125799999999 0.7533190600000026 0.2663037599999996 0.6843085499999972 0.8149602800000011 0.4936178600000005 0.6423767400000031 0.4265595800000028 0.3385836499999968 0.6767727300000033 0.4038249199999981 0.4980221900000004 0.5233227399999976 0.3019407900000033 0.3783872200000005 0.5534964699999989 0.3700369100000032 0.2689516900000015 0.5149321299999983 0.4021053000000023 0.5822628399999985 0.5512951999999984 0.2833337000000000 0.5582315199999996 0.5998261000000014 0.4423718600000015 0.6415543800000023 0.6264564600000000 0.3636066899999975 0.6610921300000001 0.6144435799999997 0.2704647199999997 0.2533369900000011 0.5954873700000007 0.2132915600000018 0.3308325499999967 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00