PUPNAQ_clean 6.889000 0.000000 0.000000 -1.229675 11.540673 0.000000 0.000000 0.000000 23.851000 1 0.729882 0.729882 0.729882 30[7-(6,6),8-(6),8-(6),8-(6)] 2 5.54428 5.54428 5.54428 30[7-(6,6),8-(6),8-(6),8-(6)] 3 4.929443 4.929443 4.929443 30[7-(6,6),8-(6),8-(6),8-(6)] 4 0.115045 0.115045 0.115045 30[7-(6,6),8-(6),8-(6),8-(6)] 5 3.042998 3.042998 3.042998 1[7-(6,6)] 6 5.184376 5.184376 5.184376 1[6-(6,6)] 7 0.282706 0.282706 0.282706 1[6-(6,6)] 8 3.608047 3.608047 3.608047 1[6-(6,7)] 9 1.158965 1.158965 1.158965 1[6-(7,7)] 10 4.016272 4.016272 4.016272 1[6-(6,6)] 11 5.467932 5.467932 5.467932 1[6-(6,6)] 12 3.043683 3.043683 3.043683 1[6-(6,6)] 13 1.590743 1.590743 1.590743 1[6-(6,6)] 14 3.163648 3.163648 3.163648 1[6-(6,6)] 15 1.773739 1.773739 1.773739 1[6-(6,6)] 16 5.550143 5.550143 5.550143 1[6-(6,6)] 17 0.04549 0.04549 0.04549 1[6-(6,6)] 18 3.231165 3.231165 3.231165 1[7-(6,6)] 19 -0.139888 -0.139888 -0.139888 1[6-(6,6)] 20 4.761781 4.761781 4.761781 1[6-(6,6)] 21 2.666115 2.666115 2.666115 1[6-(6,7)] 22 5.115198 5.115198 5.115198 1[6-(7,7)] 23 2.257891 2.257891 2.257891 1[6-(6,6)] 24 0.806231 0.806231 0.806231 1[6-(6,6)] 25 3.230479 3.230479 3.230479 1[6-(6,6)] 26 4.68342 4.68342 4.68342 1[6-(6,6)] 27 3.110514 3.110514 3.110514 1[6-(6,6)] 28 4.500424 4.500424 4.500424 1[6-(6,6)] 29 0.72402 0.72402 0.72402 1[6-(6,6)] 30 6.228672 6.228672 6.228672 1[6-(6,6)] 31 2.616327 2.616327 2.616327 1[7-(6,6)] 32 0.474949 0.474949 0.474949 1[6-(6,6)] 33 5.376619 5.376619 5.376619 1[6-(6,6)] 34 2.051278 2.051278 2.051278 1[6-(6,7)] 35 4.50036 4.50036 4.50036 1[6-(7,7)] 36 1.643053 1.643053 1.643053 1[6-(6,6)] 37 0.191393 0.191393 0.191393 1[6-(6,6)] 38 3.845317 3.845317 3.845317 1[6-(6,6)] 39 4.068582 4.068582 4.068582 1[6-(6,6)] 40 2.495677 2.495677 2.495677 1[6-(6,6)] 41 3.885586 3.885586 3.885586 1[6-(6,6)] 42 0.109182 0.109182 0.109182 1[6-(6,6)] 43 5.613835 5.613835 5.613835 1[6-(6,6)] 44 2.42816 2.42816 2.42816 1[7-(6,6)] 45 5.799213 5.799213 5.799213 1[6-(6,6)] 46 0.897544 0.897544 0.897544 1[6-(6,6)] 47 2.99321 2.99321 2.99321 1[6-(6,7)] 48 0.544127 0.544127 0.544127 1[6-(7,7)] 49 3.401434 3.401434 3.401434 1[6-(6,6)] 50 4.853094 4.853094 4.853094 1[6-(6,6)] 51 2.428846 2.428846 2.428846 1[6-(6,6)] 52 0.975905 0.975905 0.975905 1[6-(6,6)] 53 2.548811 2.548811 2.548811 1[6-(6,6)] 54 1.158901 1.158901 1.158901 1[6-(6,6)] 55 4.935305 4.935305 4.935305 1[6-(6,6)] 56 -0.569347 -0.569347 -0.569347 1[6-(6,6)] 57 5.069885 5.069885 5.069885 6[6-(1,6),6-(1,6),6-(6,7)] 58 5.622687 5.622687 5.622687 6[1-(0),6-(1,6),6-(6,6)] 59 -0.081228 -0.081228 -0.081228 6[1-(0),6-(1,6),6-(6,6)] 60 3.816572 3.816572 3.816572 6[6-(1,7),6-(6,6),7-(1,6)] 61 3.239034 3.239034 3.239034 6[1-(0),6-(6,7),7-(6,30)] 62 1.898624 1.898624 1.898624 6[1-(0),7-(1,6),7-(6,30)] 63 2.658262 2.658262 2.658262 6[6-(1,6),6-(1,6),6-(6,6)] 64 3.818648 3.818648 3.818648 6[1-(0),6-(1,6),6-(6,6)] 65 4.683375 4.683375 4.683375 6[1-(0),6-(1,6),6-(6,6)] 66 4.42103 4.42103 4.42103 6[6-(1,6),6-(1,6),6-(8,8)] 67 3.251098 3.251098 3.251098 6[1-(0),6-(1,6),6-(6,6)] 68 2.384673 2.384673 2.384673 6[1-(0),6-(1,6),6-(6,6)] 69 5.393665 5.393665 5.393665 6[6-(6,6),8-(30),8-(30)] 70 1.759753 1.759753 1.759753 6[6-(1,6),6-(1,6),6-(6,6)] 71 2.248163 2.248163 2.248163 6[1-(0),6-(1,6),6-(6,6)] 72 1.416845 1.416845 1.416845 6[1-(0),6-(1,6),6-(6,6)] 73 0.070375 0.070375 0.070375 6[6-(1,6),6-(1,6),6-(8,8)] 74 6.468112 6.468112 6.468112 6[1-(0),6-(1,6),6-(6,6)] 75 0.40728 0.40728 0.40728 6[1-(0),6-(1,6),6-(6,6)] 76 6.06869 6.06869 6.06869 6[6-(6,6),8-(0),8-(30)] 77 1.204277 1.204277 1.204277 6[6-(1,6),6-(1,6),6-(6,7)] 78 -0.578199 -0.578199 -0.578199 6[1-(0),6-(1,6),6-(6,6)] 79 5.125715 5.125715 5.125715 6[1-(0),6-(1,6),6-(6,6)] 80 2.457591 2.457591 2.457591 6[6-(1,7),6-(6,6),7-(1,6)] 81 3.035128 3.035128 3.035128 6[1-(0),6-(6,7),7-(6,30)] 82 4.375539 4.375539 4.375539 6[1-(0),7-(1,6),7-(6,30)] 83 3.615901 3.615901 3.615901 6[6-(1,6),6-(1,6),6-(6,6)] 84 2.455515 2.455515 2.455515 6[1-(0),6-(1,6),6-(6,6)] 85 1.590787 1.590787 1.590787 6[1-(0),6-(1,6),6-(6,6)] 86 1.853133 1.853133 1.853133 6[6-(1,6),6-(1,6),6-(8,8)] 87 3.023064 3.023064 3.023064 6[1-(0),6-(1,6),6-(6,6)] 88 3.889489 3.889489 3.889489 6[1-(0),6-(1,6),6-(6,6)] 89 0.880497 0.880497 0.880497 6[6-(6,6),8-(30),8-(30)] 90 4.514409 4.514409 4.514409 6[6-(1,6),6-(1,6),6-(6,6)] 91 4.026 4.026 4.026 6[1-(0),6-(1,6),6-(6,6)] 92 4.857317 4.857317 4.857317 6[1-(0),6-(1,6),6-(6,6)] 93 6.203787 6.203787 6.203787 6[6-(1,6),6-(1,6),6-(8,8)] 94 -0.19395 -0.19395 -0.19395 6[1-(0),6-(1,6),6-(6,6)] 95 5.866882 5.866882 5.866882 6[1-(0),6-(1,6),6-(6,6)] 96 0.205472 0.205472 0.205472 6[6-(6,6),8-(0),8-(30)] 97 0.58944 0.58944 0.58944 6[6-(1,6),6-(1,6),6-(6,7)] 98 0.036638 0.036638 0.036638 6[1-(0),6-(1,6),6-(6,6)] 99 5.740553 5.740553 5.740553 6[1-(0),6-(1,6),6-(6,6)] 100 1.842753 1.842753 1.842753 6[6-(1,7),6-(6,6),7-(1,6)] 101 2.420291 2.420291 2.420291 6[1-(0),6-(6,7),7-(6,30)] 102 3.760701 3.760701 3.760701 6[1-(0),7-(1,6),7-(6,30)] 103 3.001063 3.001063 3.001063 6[6-(1,6),6-(1,6),6-(6,6)] 104 1.840677 1.840677 1.840677 6[1-(0),6-(1,6),6-(6,6)] 105 0.97595 0.97595 0.97595 6[1-(0),6-(1,6),6-(6,6)] 106 1.238295 1.238295 1.238295 6[6-(1,6),6-(1,6),6-(8,8)] 107 2.408227 2.408227 2.408227 6[1-(0),6-(1,6),6-(6,6)] 108 3.274652 3.274652 3.274652 6[1-(0),6-(1,6),6-(6,6)] 109 0.26566 0.26566 0.26566 6[6-(6,6),8-(30),8-(30)] 110 3.899572 3.899572 3.899572 6[6-(1,6),6-(1,6),6-(6,6)] 111 3.411162 3.411162 3.411162 6[1-(0),6-(1,6),6-(6,6)] 112 4.24248 4.24248 4.24248 6[1-(0),6-(1,6),6-(6,6)] 113 5.58895 5.58895 5.58895 6[6-(1,6),6-(1,6),6-(8,8)] 114 -0.808787 -0.808787 -0.808787 6[1-(0),6-(1,6),6-(6,6)] 115 5.252045 5.252045 5.252045 6[1-(0),6-(1,6),6-(6,6)] 116 -0.409365 -0.409365 -0.409365 6[6-(6,6),8-(0),8-(30)] 117 4.455048 4.455048 4.455048 6[6-(1,6),6-(1,6),6-(6,7)] 118 6.237524 6.237524 6.237524 6[1-(0),6-(1,6),6-(6,6)] 119 0.53361 0.53361 0.53361 6[1-(0),6-(1,6),6-(6,6)] 120 3.201734 3.201734 3.201734 6[6-(1,7),6-(6,6),7-(1,6)] 121 2.624197 2.624197 2.624197 6[1-(0),6-(6,7),7-(6,30)] 122 1.283786 1.283786 1.283786 6[1-(0),7-(1,6),7-(6,30)] 123 2.043424 2.043424 2.043424 6[6-(1,6),6-(1,6),6-(6,6)] 124 3.20381 3.20381 3.20381 6[1-(0),6-(1,6),6-(6,6)] 125 4.068538 4.068538 4.068538 6[1-(0),6-(1,6),6-(6,6)] 126 3.806192 3.806192 3.806192 6[6-(1,6),6-(1,6),6-(8,8)] 127 2.636261 2.636261 2.636261 6[1-(0),6-(1,6),6-(6,6)] 128 1.769836 1.769836 1.769836 6[1-(0),6-(1,6),6-(6,6)] 129 4.778828 4.778828 4.778828 6[6-(6,6),8-(30),8-(30)] 130 1.144916 1.144916 1.144916 6[6-(1,6),6-(1,6),6-(6,6)] 131 1.633325 1.633325 1.633325 6[1-(0),6-(1,6),6-(6,6)] 132 0.802008 0.802008 0.802008 6[1-(0),6-(1,6),6-(6,6)] 133 -0.544462 -0.544462 -0.544462 6[6-(1,6),6-(1,6),6-(8,8)] 134 5.853275 5.853275 5.853275 6[1-(0),6-(1,6),6-(6,6)] 135 -0.207557 -0.207557 -0.207557 6[1-(0),6-(1,6),6-(6,6)] 136 5.453853 5.453853 5.453853 6[6-(6,6),8-(0),8-(30)] 137 2.936931 2.936931 2.936931 7[1-(0),6-(1,7),6-(6,6)] 138 2.036937 2.036937 2.036937 7[6-(1,6),6-(1,7),30-(8,8,8)] 139 3.337232 3.337232 3.337232 7[1-(0),6-(1,7),6-(6,6)] 140 4.237225 4.237225 4.237225 7[6-(1,6),6-(1,7),30-(8,8,8)] 141 2.722394 2.722394 2.722394 7[1-(0),6-(1,7),6-(6,6)] 142 3.622388 3.622388 3.622388 7[6-(1,6),6-(1,7),30-(8,8,8)] 143 2.322093 2.322093 2.322093 7[1-(0),6-(1,7),6-(6,6)] 144 1.4221 1.4221 1.4221 7[6-(1,6),6-(1,7),30-(8,8,8)] 145 6.416861 6.416861 6.416861 8[6-(6,8),30-(7,8,8)] 146 5.146453 5.146453 5.146453 8[6-(6,8),30-(7,8,8)] 147 -0.255656 -0.255656 -0.255656 8[6-(6,8),30-(7,8,8)] 148 4.868613 4.868613 4.868613 8[6-(6,8)] 149 -0.142699 -0.142699 -0.142699 8[6-(6,8),30-(7,8,8)] 150 1.12771 1.12771 1.12771 8[6-(6,8),30-(7,8,8)] 151 6.529818 6.529818 6.529818 8[6-(6,8),30-(7,8,8)] 152 1.40555 1.40555 1.40555 8[6-(6,8)] 153 -0.757536 -0.757536 -0.757536 8[6-(6,8),30-(7,8,8)] 154 1.742547 1.742547 1.742547 8[6-(6,8),30-(7,8,8)] 155 5.914981 5.914981 5.914981 8[6-(6,8),30-(7,8,8)] 156 0.790712 0.790712 0.790712 8[6-(6,8)] 157 5.802024 5.802024 5.802024 8[6-(6,8),30-(7,8,8)] 158 4.531615 4.531615 4.531615 8[6-(6,8),30-(7,8,8)] 159 -0.870493 -0.870493 -0.870493 8[6-(6,8),30-(7,8,8)] 160 4.253775 4.253775 4.253775 8[6-(6,8)]