No title
1.0
11.08690000 0.00000000 0.00000000
5.54345000 9.60153705 0.00000000
0.00000000 0.00000000 33.05240000
Pt S H O
64 1 4 4
Direct
0.65766839 0.66474379 0.99970343 # 1 Pt1
0.40828876 0.91341883 0.99960586 # 2 Pt2
0.40785567 0.66390509 0.99980097 # 3 Pt3
0.15749113 0.91396019 0.99982683 # 4 Pt4
0.90826045 0.41360020 0.99978231 # 5 Pt5
0.90780894 0.16407368 0.99996629 # 6 Pt6
0.65791868 0.41355800 0.99977429 # 7 Pt7
0.15734288 0.16439797 0.99974710 # 8 Pt8
0.90811186 0.91365718 0.99984842 # 9 Pt9
0.90778010 0.66399841 0.99985582 # 10 Pt10
0.65788061 0.91319981 0.99959999 # 11 Pt11
0.15769640 0.66383676 0.99983870 # 12 Pt12
0.65783190 0.16432249 0.99971824 # 13 Pt13
0.40855515 0.41354530 0.99955200 # 14 Pt14
0.40761322 0.16415881 0.99959197 # 15 Pt15
0.15790767 0.41399733 0.99970820 # 16 Pt16
0.73975139 0.74771048 0.06965700 # 17 Pt17
0.73945196 0.49832426 0.06882514 # 18 Pt18
0.49035981 0.74743905 0.06961018 # 19 Pt19
0.99027476 0.49813420 0.06914599 # 20 Pt20
0.49057632 0.99718587 0.06872730 # 21 Pt21
0.23977904 0.24722581 0.06861215 # 22 Pt22
0.24027123 0.99693683 0.06872100 # 23 Pt23
0.98881358 0.24821701 0.06962634 # 24 Pt24
0.48989652 0.49827128 0.06917015 # 25 Pt25
0.24023094 0.74839764 0.06920738 # 26 Pt26
0.24043219 0.49838592 0.06878580 # 27 Pt27
0.99010455 0.74760159 0.06947817 # 28 Pt28
0.74011654 0.24809391 0.06967985 # 29 Pt29
0.74026611 0.99766976 0.06850789 # 30 Pt30
0.49046169 0.24787219 0.06870260 # 31 Pt31
0.98961221 0.99806291 0.06959393 # 32 Pt32
0.32058593 0.33219189 0.13588240 # 33 Pt33
0.06876266 0.58305308 0.13810613 # 34 Pt34
0.07180484 0.33176105 0.13680584 # 35 Pt35
0.82203270 0.58128909 0.13762553 # 36 Pt36
0.57235986 0.08154772 0.13627042 # 37 Pt37
0.57275906 0.83023457 0.13816227 # 38 Pt38
0.32179229 0.08139140 0.13615039 # 39 Pt39
0.82170432 0.83181231 0.13746353 # 40 Pt40
0.57176544 0.58156604 0.13820571 # 41 Pt41
0.57139474 0.33214655 0.13672528 # 42 Pt42
0.32078906 0.58305972 0.13718681 # 43 Pt43
0.82111324 0.33158530 0.13835186 # 44 Pt44
0.32236705 0.83091276 0.13774030 # 45 Pt45
0.07061842 0.08312860 0.13772635 # 46 Pt46
0.07150573 0.83234706 0.13723983 # 47 Pt47
0.82232383 0.08264103 0.13786168 # 48 Pt48
0.40137842 0.41425958 0.20496585 # 49 Pt49
0.40298213 0.16640426 0.20602153 # 50 Pt50
0.15322061 0.41588321 0.20655106 # 51 Pt51
0.65268969 0.16563266 0.20646162 # 52 Pt52
0.15067698 0.66686013 0.20640389 # 53 Pt53
0.90242722 0.91674928 0.20676079 # 54 Pt54
0.90129069 0.66682016 0.21081150 # 55 Pt55
0.65180601 0.91956509 0.20660939 # 56 Pt56
0.15395557 0.16634477 0.20655223 # 57 Pt57
0.90567098 0.41411124 0.20640604 # 58 Pt58
0.90326047 0.16613223 0.21092122 # 59 Pt59
0.65255346 0.41336186 0.20750720 # 60 Pt60
0.40233231 0.91953553 0.20604005 # 61 Pt61
0.40095897 0.66789098 0.20797404 # 62 Pt62
0.15170780 0.91825044 0.20629551 # 63 Pt63
0.65439745 0.66363624 0.20940321 # 64 Pt64
0.48638422 0.53123551 0.29596338 # 65 S1
0.39897019 0.40407347 0.27159904 # 66 H1
0.90168482 0.16412493 0.25792736 # 67 H2
0.60215282 0.64955092 0.27809039 # 68 H3
0.80658192 0.69517121 0.24962735 # 69 H4
0.40034918 0.45731211 0.29456141 # 70 O1
0.49356831 0.55143477 0.33874369 # 71 O2
0.39461304 0.66810078 0.27417182 # 72 O3
0.66750693 0.55389791 0.27745483 # 73 O4