0 mol 9 unq 0 iso 0 dist 6.85412 9.62394 4.45625 5.60154 9.29529 9.57198 8.57077 8.27962 9.5997 8.47421 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.33889 9.62394 6.0397 5.60154 7.2199 9.57198 8.57077 11.4878 9.5997 8.47421 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.78293 7.75618 6.2337 5.5841 9.95011 7.02548 7.20519 5.31524 4.96411 9.80108 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 8.78293 7.75618 6.2337 5.5841 9.95011 7.02548 6.864 11.4401 7.08342 8.58657 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 8.23643 7.75618 14.4867 5.5841 13.6944 7.02548 7.20519 11.0832 4.96411 9.80108 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 8.23643 7.75618 14.4867 5.5841 13.6944 7.02548 6.864 12.3093 7.08342 8.58657 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 6.20943 8.40416 11.4087 6.74265 10.7418 7.02548 10.4091 10.4988 4.96411 9.80108 numMergedOcc 0
7 mol 19 unq 5 iso 0 dist 6.20943 8.40416 11.4087 6.74265 10.7418 7.02548 4.51865 4.69858 7.08342 8.58657 numMergedOcc 0
8 mol 19 unq 6 iso 0 dist 7.82528 7.75618 11.4087 5.5841 10.7418 7.02548 7.20519 10.4988 4.96411 9.80108 numMergedOcc 0
9 mol 19 unq 7 iso 0 dist 7.82528 7.75618 11.4087 5.5841 10.7418 7.02548 6.864 4.69858 7.08342 8.58657 numMergedOcc 0
10 mol 19 unq 8 iso 0 dist 8.58657 6.41423 5.90856 4.69858 10.7418 5.82366 9.56313 12.0759 6.42867 6.00439 numMergedOcc 0
11 mol 19 unq 9 iso 0 dist 8.58657 6.41423 5.90856 4.69858 10.7418 5.82366 4.51865 6.74265 4.64838 6.20943 numMergedOcc 0
12 mol 19 unq 10 iso 0 dist 8.58657 6.41423 5.90856 4.69858 10.7418 5.82366 6.864 5.5841 4.97119 7.82528 numMergedOcc 0
13 mol 45 unq 0 iso 0 dist 9.43442 9.53378 8.70414 5.54436 8.59109 5.55096 11.5838 5.67689 10.7082 9.20119 numMergedOcc 0
14 mol 58 unq 0 iso 0 dist 8.26899 7.21955 10.8421 6.75888 8.80108 8.71468 7.32874 4.55117 7.12541 6.40841 numMergedOcc 0
15 mol 58 unq 1 iso 0 dist 8.26899 7.21955 10.8421 6.75888 8.80108 8.71468 13.4544 14.7581 11.387 7.58407 numMergedOcc 0
16 mol 58 unq 2 iso 0 dist 8.26899 7.21955 10.8421 6.75888 8.80108 8.71468 9.55426 10.3782 5.74871 6.31428 numMergedOcc 0
17 mol 58 unq 3 iso 0 dist 9.58673 8.80614 8.88332 13.9007 15.9804 7.6481 18.1669 15.0247 9.62267 8.81638 numMergedOcc 0
18 mol 58 unq 4 iso 0 dist 9.58673 8.80614 8.88332 6.47744 7.01363 9.11258 6.86465 5.92889 10.2049 8.63333 numMergedOcc 0
19 mol 58 unq 5 iso 0 dist 9.58673 8.80614 8.88332 6.47744 7.01363 9.11258 6.35756 7.05413 5.49591 8.89374 numMergedOcc 0
20 mol 58 unq 6 iso 0 dist 9.58673 8.80614 8.88332 6.47744 7.01363 9.11258 10.3224 6.61756 5.85698 6.46761 numMergedOcc 0
21 mol 58 unq 7 iso 0 dist 9.58673 8.80614 8.88332 6.47744 7.01363 9.11258 15.4557 8.94672 12.2123 9.73139 numMergedOcc 0
22 mol 59 unq 0 iso 0 dist 8.24062 6.73347 7.0313 5.33688 6.5096 9.2902 7.71095 5.3525 9.64444 6.71911 numMergedOcc 0
23 mol 92 unq 0 iso 0 dist 7.96555 5.37007 6.85455 9.97281 13.3416 7.1539 12.4557 12.3435 8.55834 5.81965 numMergedOcc 0
24 mol 92 unq 1 iso 0 dist 7.96555 5.37007 6.85455 9.97281 13.3416 7.1539 10.2618 11.145 8.51055 7.06013 numMergedOcc 0
25 mol 92 unq 2 iso 0 dist 7.96555 5.37007 6.85455 9.97281 13.3416 7.1539 13.0635 11.3503 7.76866 9.70512 numMergedOcc 0
26 mol 126 unq 0 iso 0 dist 9.5574 6.29233 6.36036 5.15767 10.4559 5.14819 12.1603 11.3045 8.01268 7.75534 numMergedOcc 0
27 mol 126 unq 1 iso 0 dist 9.5574 6.29233 6.36036 5.15767 10.4559 5.14819 10.4642 5.05336 6.51507 9.06011 numMergedOcc 0
28 mol 126 unq 2 iso 0 dist 9.5574 5.42406 4.28167 5.15767 10.4559 6.84245 12.1603 11.3045 10.2072 7.75534 numMergedOcc 0
29 mol 126 unq 3 iso 0 dist 9.5574 5.42406 4.28167 5.15767 10.4559 6.84245 10.4642 5.05336 5.78149 9.06011 numMergedOcc 0
30 mol 155 unq 0 iso 0 dist 9.87281 8.69157 7.6506 5.48883 6.51096 9.0529 12.1555 4.9093 10.4923 7.16254 numMergedOcc 0
31 mol 155 unq 1 iso 0 dist 9.87281 8.69157 7.6506 5.48883 6.51096 9.0529 12.3052 6.3437 6.89781 9.14392 numMergedOcc 0
32 mol 155 unq 2 iso 0 dist 9.87281 8.69157 7.6506 8.78665 10.3514 7.55196 12.1555 4.9093 10.4923 9.86313 numMergedOcc 0
33 mol 155 unq 3 iso 0 dist 9.87281 8.69157 7.6506 8.78665 10.3514 7.55196 12.3052 6.3437 6.89781 7.51198 numMergedOcc 0
34 mol 155 unq 4 iso 0 dist 9.38946 7.92304 9.50478 6.34186 11.3251 9.80845 10.2463 18.174 11.0769 9.86313 numMergedOcc 0
35 mol 155 unq 5 iso 0 dist 9.38946 7.92304 9.50478 6.34186 11.3251 9.80845 6.43582 12.8482 5.50031 7.51198 numMergedOcc 0
36 mol 155 unq 6 iso 0 dist 7.39644 6.53347 6.40403 9.36596 13.2154 9.0529 13.5605 13.5062 10.4923 7.16254 numMergedOcc 0
37 mol 155 unq 7 iso 0 dist 7.39644 6.53347 6.40403 9.36596 13.2154 9.0529 10.7829 8.27726 6.89781 9.14392 numMergedOcc 0
38 mol 155 unq 8 iso 0 dist 7.39644 6.53347 6.40403 5.40375 7.37901 7.55196 13.5605 13.5062 10.4923 9.86313 numMergedOcc 0
39 mol 155 unq 9 iso 0 dist 7.39644 6.53347 6.40403 5.40375 7.37901 7.55196 10.7829 8.27726 6.89781 7.51198 numMergedOcc 0
40 mol 155 unq 10 iso 0 dist 7.36102 7.92304 5.50045 6.34186 7.37901 9.80845 10.2463 13.5062 11.0769 9.86313 numMergedOcc 0
41 mol 155 unq 11 iso 0 dist 7.36102 7.92304 5.50045 6.34186 7.37901 9.80845 6.43582 8.27726 5.50031 7.51198 numMergedOcc 0
42 mol 155 unq 12 iso 0 dist 8.65888 8.69157 4.40321 5.48883 11.1032 9.0529 12.1555 13.9869 10.4923 7.16254 numMergedOcc 0
43 mol 155 unq 13 iso 0 dist 8.65888 8.69157 4.40321 5.48883 11.1032 9.0529 12.3052 11.1591 6.89781 9.14392 numMergedOcc 0
44 mol 155 unq 14 iso 0 dist 8.65888 8.69157 4.40321 8.78665 10.9049 7.55196 12.1555 13.9869 10.4923 9.86313 numMergedOcc 0
45 mol 155 unq 15 iso 0 dist 8.65888 8.69157 4.40321 8.78665 10.9049 7.55196 12.3052 11.1591 6.89781 7.51198 numMergedOcc 0
46 mol 155 unq 16 iso 0 dist 7.70572 6.53347 4.40321 9.36596 11.1032 9.0529 13.5605 13.9869 10.4923 7.16254 numMergedOcc 0
47 mol 155 unq 17 iso 0 dist 7.70572 6.53347 4.40321 9.36596 11.1032 9.0529 10.7829 11.1591 6.89781 9.14392 numMergedOcc 0
48 mol 155 unq 18 iso 0 dist 7.70572 6.53347 4.40321 5.40375 10.9049 7.55196 13.5605 13.9869 10.4923 9.86313 numMergedOcc 0
49 mol 155 unq 19 iso 0 dist 7.70572 6.53347 4.40321 5.40375 10.9049 7.55196 10.7829 11.1591 6.89781 7.51198 numMergedOcc 0
50 mol 155 unq 20 iso 0 dist 8.27111 8.69157 6.00473 5.48883 8.73171 9.0529 12.1555 10.7896 10.4923 7.16254 numMergedOcc 0
51 mol 155 unq 21 iso 0 dist 8.27111 8.69157 6.00473 5.48883 8.73171 9.0529 12.3052 9.99927 6.89781 9.14392 numMergedOcc 0
52 mol 155 unq 22 iso 0 dist 8.27111 8.69157 6.00473 8.78665 11.8293 7.55196 12.1555 10.7896 10.4923 9.86313 numMergedOcc 0
53 mol 155 unq 23 iso 0 dist 8.27111 8.69157 6.00473 8.78665 11.8293 7.55196 12.3052 9.99927 6.89781 7.51198 numMergedOcc 0
54 mol 156 unq 0 iso 0 dist 7.36119 7.30357 11.9671 5.07967 12.2304 7.30946 10.2717 16.8595 6.14767 6.88137 numMergedOcc 0
55 mol 156 unq 1 iso 0 dist 9.36805 9.44367 10.143 7.29758 6.90155 5.81122 7.44554 6.29785 5.4555 6.27641 numMergedOcc 0
56 mol 181 unq 0 iso 0 dist 6.94688 8.90963 4.43678 8.25067 8.20656 5.95304 9.15386 6.80228 9.34211 9.6668 numMergedOcc 0
57 mol 181 unq 1 iso 0 dist 6.71012 8.90963 6.03415 8.25067 9.40622 5.95304 9.15386 11.6919 9.34211 9.6668 numMergedOcc 0
58 mol 181 unq 2 iso 0 dist 7.20046 7.99195 4.69841 5.86342 10.5561 9.06217 5.98885 5.4601 6.6251 6.94688 numMergedOcc 0
59 mol 181 unq 3 iso 0 dist 7.20046 7.99195 4.69841 9.14057 9.94131 7.13252 5.98885 5.4601 6.6251 6.71012 numMergedOcc 0
60 mol 181 unq 4 iso 0 dist 7.13543 7.99195 7.23063 5.86342 11.7007 9.06217 5.98885 10.0524 6.6251 6.94688 numMergedOcc 0
61 mol 181 unq 5 iso 0 dist 7.13543 7.99195 7.23063 9.14057 12.8673 7.13252 5.98885 10.0524 6.6251 6.71012 numMergedOcc 0
62 mol 181 unq 6 iso 0 dist 6.93764 5.9176 5.60306 9.60512 10.7841 5.97685 7.63312 4.80231 5.63555 7.98142 numMergedOcc 0
63 mol 181 unq 7 iso 0 dist 6.93764 5.9176 5.60306 13.3389 11.1129 8.9289 7.63312 4.80231 5.63555 7.37327 numMergedOcc 0
64 mol 181 unq 8 iso 0 dist 7.98142 5.94469 8.93991 6.7991 12.2455 7.05653 7.81386 9.53462 7.77758 4.93785 numMergedOcc 0
65 mol 181 unq 9 iso 0 dist 7.37327 5.94469 5.35588 6.7991 11.691 7.05653 7.81386 11.1462 7.77758 4.93785 numMergedOcc 0
66 mol 234 unq 0 iso 0 dist 6.16063 7.32499 7.17691 5.9221 8.49841 7.43663 10.3625 5.56749 10.0059 9.5707 numMergedOcc 0
67 mol 234 unq 1 iso 0 dist 6.16063 7.32499 7.17691 13.2297 11.8534 7.94068 11.0622 8.0608 5.08515 9.39181 numMergedOcc 0
68 mol 235 unq 0 iso 0 dist 5.65339 6.95126 4.29892 6.43692 7.27958 7.95766 11.3258 10.6981 7.60081 8.21247 numMergedOcc 0
69 mol 235 unq 1 iso 0 dist 9.58736 9.55668 13.128 4.65302 11.9287 7.95766 5.4638 9.66021 7.60081 8.21247 numMergedOcc 0
70 mol 238 unq 0 iso 0 dist 9.29858 9.24557 10.3809 11.0401 16.2894 8.90076 15.1497 21.5749 12.2874 8.14172 numMergedOcc 0
71 mol 238 unq 1 iso 0 dist 9.29858 9.24557 10.3809 11.0401 16.2894 8.90076 10.3007 17.9091 10.4017 6.77463 numMergedOcc 0
72 mol 238 unq 2 iso 0 dist 9.29858 9.24557 10.3809 11.9142 16.7658 8.09718 16.4238 20.8738 10.7081 6.05141 numMergedOcc 0
73 mol 238 unq 3 iso 0 dist 9.29858 9.24557 10.3809 11.9142 16.7658 8.09718 15.1497 21.5749 12.2874 8.09066 numMergedOcc 0
74 mol 238 unq 4 iso 0 dist 9.29858 9.24557 10.3809 11.9142 16.7658 8.09718 10.3007 17.9091 10.4017 7.2766 numMergedOcc 0
75 mol 238 unq 5 iso 0 dist 9.90142 7.57812 10.3147 5.11565 14.5719 8.90076 12.8275 21.1459 12.2874 8.14172 numMergedOcc 0
76 mol 238 unq 6 iso 0 dist 9.90142 7.57812 10.3147 5.11565 14.5719 8.90076 10.7456 17.9809 10.4017 6.77463 numMergedOcc 0
77 mol 238 unq 7 iso 0 dist 9.90142 7.57812 10.3147 13.171 17.8749 8.09718 13.9668 20.7986 10.7081 6.05141 numMergedOcc 0
78 mol 238 unq 8 iso 0 dist 9.90142 7.57812 10.3147 13.171 17.8749 8.09718 12.8275 21.1459 12.2874 8.09066 numMergedOcc 0
79 mol 238 unq 9 iso 0 dist 9.90142 7.57812 10.3147 13.171 17.8749 8.09718 10.7456 17.9809 10.4017 7.2766 numMergedOcc 0
80 mol 238 unq 10 iso 0 dist 9.90142 8.69104 15.6823 5.11565 14.5719 6.62002 12.8275 21.1459 7.11984 8.14172 numMergedOcc 0
81 mol 238 unq 11 iso 0 dist 9.90142 8.69104 15.6823 5.11565 14.5719 6.62002 10.7456 17.9809 7.95232 6.77463 numMergedOcc 0
82 mol 238 unq 12 iso 0 dist 9.90142 8.69104 15.6823 13.171 17.8749 6.73446 13.9668 20.7986 5.50308 6.05141 numMergedOcc 0
83 mol 238 unq 13 iso 0 dist 9.90142 8.69104 15.6823 13.171 17.8749 6.73446 12.8275 21.1459 7.11984 8.09066 numMergedOcc 0
84 mol 238 unq 14 iso 0 dist 9.90142 8.69104 15.6823 13.171 17.8749 6.73446 10.7456 17.9809 7.95232 7.2766 numMergedOcc 0
