0 mol 9 unq 0 iso 0 dist 8.47421 8.27962 9.29529 9.5997 9.57198 4.45625 8.57077 5.60154 6.85412 9.62394 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.47421 11.4878 7.2199 9.5997 9.57198 6.0397 8.57077 5.60154 6.33889 9.62394 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 9.53002 7.85924 5.43238 10.9183 8.73067 8.17605 14.7815 8.05213 10.0658 5.96346 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 9.77484 10.1814 8.11206 14.3929 7.60283 7.47886 17.0333 7.50515 12.4741 9.52474 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 9.20119 5.67689 8.59109 10.7082 5.55096 8.70414 11.5838 5.54436 9.43442 9.53378 numMergedOcc 0
5 mol 45 unq 1 iso 0 dist 9.20119 16.2375 8.13782 10.7082 5.55096 6.39184 11.5838 5.54436 11.2545 9.53378 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 6.40841 4.55117 8.80108 7.12541 8.71468 10.8421 7.32874 6.75888 8.26899 7.21955 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 6.40841 5.64209 6.50297 7.12541 8.71468 11.3634 7.32874 6.75888 11.3177 7.21955 numMergedOcc 0
8 mol 58 unq 2 iso 0 dist 8.63333 10.6476 6.96494 10.2049 9.11258 13.4366 6.86465 6.47744 12.4575 8.80614 numMergedOcc 0
9 mol 58 unq 3 iso 0 dist 8.63333 5.92889 7.01363 10.2049 9.11258 8.88332 6.86465 6.47744 9.58673 8.80614 numMergedOcc 0
10 mol 58 unq 4 iso 0 dist 8.89374 12.7331 6.96494 5.49591 9.11258 13.4366 6.35756 6.47744 12.4575 8.80614 numMergedOcc 0
11 mol 58 unq 5 iso 0 dist 8.89374 7.05413 7.01363 5.49591 9.11258 8.88332 6.35756 6.47744 9.58673 8.80614 numMergedOcc 0
12 mol 58 unq 6 iso 0 dist 6.46761 8.74789 6.96494 5.85698 9.11258 13.4366 10.3224 6.47744 12.4575 8.80614 numMergedOcc 0
13 mol 58 unq 7 iso 0 dist 6.46761 6.61756 7.01363 5.85698 9.11258 8.88332 10.3224 6.47744 9.58673 8.80614 numMergedOcc 0
14 mol 58 unq 8 iso 0 dist 7.58407 14.7581 8.80108 11.387 8.71468 10.8421 13.4544 6.75888 8.26899 7.21955 numMergedOcc 0
15 mol 58 unq 9 iso 0 dist 7.58407 8.74789 6.50297 11.387 8.71468 11.3634 13.4544 6.75888 11.3177 7.21955 numMergedOcc 0
16 mol 58 unq 10 iso 0 dist 9.73139 7.02095 6.96494 12.2123 9.11258 13.4366 15.4557 6.47744 12.4575 8.80614 numMergedOcc 0
17 mol 58 unq 11 iso 0 dist 9.73139 8.94672 7.01363 12.2123 9.11258 8.88332 15.4557 6.47744 9.58673 8.80614 numMergedOcc 0
18 mol 58 unq 12 iso 0 dist 6.31428 10.3782 8.80108 5.74871 8.71468 10.8421 9.55426 6.75888 8.26899 7.21955 numMergedOcc 0
19 mol 58 unq 13 iso 0 dist 6.31428 7.02095 6.50297 5.74871 8.71468 11.3634 9.55426 6.75888 11.3177 7.21955 numMergedOcc 0
20 mol 59 unq 0 iso 0 dist 6.71911 5.3525 6.5096 9.64444 9.2902 7.0313 7.71095 5.33688 8.24062 6.73347 numMergedOcc 0
21 mol 64 unq 0 iso 0 dist 8.68586 5.35421 8.4517 6.21578 9.32552 6.90629 9.67592 5.3948 11.9355 9.97159 numMergedOcc 0
22 mol 64 unq 1 iso 0 dist 9.54144 5.68303 8.4517 11.4485 9.32552 6.90629 14.5656 5.3948 11.9355 9.97159 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 7.92688 11.8989 9.94276 5.92062 6.51868 6.00607 7.11802 4.68409 14.0449 9.22661 numMergedOcc 0
24 mol 133 unq 1 iso 0 dist 7.92688 11.8989 9.94276 6.61891 7.34698 12.0514 7.11802 4.68409 14.0449 7.56378 numMergedOcc 0
25 mol 133 unq 2 iso 0 dist 7.92688 15.0734 9.05357 5.92062 6.51868 10.2267 7.11802 4.68409 13.5624 9.22661 numMergedOcc 0
26 mol 133 unq 3 iso 0 dist 7.92688 15.0734 9.05357 6.61891 7.34698 14.5639 7.11802 4.68409 13.5624 7.56378 numMergedOcc 0
27 mol 133 unq 4 iso 0 dist 7.92688 9.58627 5.99299 5.92062 6.51868 5.59913 7.11802 4.68409 9.65709 9.22661 numMergedOcc 0
28 mol 133 unq 5 iso 0 dist 7.92688 9.58627 5.99299 6.61891 7.34698 6.27692 7.11802 4.68409 9.65709 7.56378 numMergedOcc 0
29 mol 155 unq 0 iso 0 dist 7.16254 4.9093 6.51096 10.4923 9.0529 7.6506 12.1555 5.48883 9.87281 8.69157 numMergedOcc 0
30 mol 155 unq 1 iso 0 dist 7.16254 4.9093 6.51096 10.4923 9.0529 7.6506 13.5605 9.36596 12.0728 6.53347 numMergedOcc 0
31 mol 155 unq 2 iso 0 dist 7.16254 10.7896 8.73171 10.4923 9.0529 6.00473 12.1555 5.48883 8.27111 8.69157 numMergedOcc 0
32 mol 155 unq 3 iso 0 dist 7.16254 10.7896 8.73171 10.4923 9.0529 6.00473 13.5605 9.36596 10.6403 6.53347 numMergedOcc 0
33 mol 155 unq 4 iso 0 dist 9.86313 13.5062 7.37901 11.0769 9.80845 5.50045 10.2463 6.34186 7.36102 7.92304 numMergedOcc 0
34 mol 155 unq 5 iso 0 dist 9.86313 13.5062 7.37901 10.4923 7.55196 6.40403 12.1555 8.78665 13.1369 8.69157 numMergedOcc 0
35 mol 155 unq 6 iso 0 dist 9.86313 13.5062 7.37901 10.4923 7.55196 6.40403 13.5605 5.40375 7.39644 6.53347 numMergedOcc 0
36 mol 155 unq 7 iso 0 dist 9.14392 6.3437 6.51096 6.89781 9.0529 7.6506 12.3052 5.48883 9.87281 8.69157 numMergedOcc 0
37 mol 155 unq 8 iso 0 dist 9.14392 6.3437 6.51096 6.89781 9.0529 7.6506 10.7829 9.36596 12.0728 6.53347 numMergedOcc 0
38 mol 155 unq 9 iso 0 dist 9.14392 9.99927 8.73171 6.89781 9.0529 6.00473 12.3052 5.48883 8.27111 8.69157 numMergedOcc 0
39 mol 155 unq 10 iso 0 dist 9.14392 9.99927 8.73171 6.89781 9.0529 6.00473 10.7829 9.36596 10.6403 6.53347 numMergedOcc 0
40 mol 155 unq 11 iso 0 dist 7.51198 8.27726 7.37901 5.50031 9.80845 5.50045 6.43582 6.34186 7.36102 7.92304 numMergedOcc 0
41 mol 155 unq 12 iso 0 dist 7.51198 8.27726 7.37901 6.89781 7.55196 6.40403 12.3052 8.78665 13.1369 8.69157 numMergedOcc 0
42 mol 155 unq 13 iso 0 dist 7.51198 8.27726 7.37901 6.89781 7.55196 6.40403 10.7829 5.40375 7.39644 6.53347 numMergedOcc 0
43 mol 156 unq 0 iso 0 dist 6.27641 6.29785 6.90155 5.4555 5.81122 10.143 7.44554 7.29758 9.36805 9.44367 numMergedOcc 0
44 mol 156 unq 1 iso 0 dist 6.27641 6.29785 6.90155 5.4555 5.81122 10.143 8.94056 8.67156 13.1853 7.90267 numMergedOcc 0
45 mol 175 unq 0 iso 0 dist 9.8589 11.0415 4.79852 8.29015 5.4997 4.30489 6.57069 7.5414 11.3137 9.77896 numMergedOcc 0
46 mol 175 unq 1 iso 0 dist 7.24908 5.0384 4.79852 4.63177 5.4997 4.30489 10.2623 7.5414 11.3137 9.77896 numMergedOcc 0
47 mol 181 unq 0 iso 0 dist 6.94688 8.25067 8.20656 6.6251 9.06217 14.048 9.1374 6.25083 13.2702 6.2479 numMergedOcc 0
48 mol 181 unq 1 iso 0 dist 6.94688 8.25067 8.20656 6.6251 9.06217 14.048 9.94371 10.5753 14.8211 6.22122 numMergedOcc 0
49 mol 181 unq 2 iso 0 dist 6.94688 8.25067 8.20656 6.6251 9.06217 14.048 5.98885 5.86342 10.8351 7.99195 numMergedOcc 0
50 mol 181 unq 3 iso 0 dist 6.71012 8.25067 9.40622 6.6251 7.13252 14.048 9.1374 4.77278 13.2702 6.2479 numMergedOcc 0
51 mol 181 unq 4 iso 0 dist 6.71012 8.25067 9.40622 6.6251 7.13252 14.048 9.94371 5.88819 14.8211 6.22122 numMergedOcc 0
52 mol 181 unq 5 iso 0 dist 6.71012 8.25067 9.40622 6.6251 7.13252 14.048 5.98885 9.14057 10.8351 7.99195 numMergedOcc 0
53 mol 181 unq 6 iso 0 dist 9.6668 6.80228 8.20656 9.34211 5.95304 4.43678 9.15386 8.25067 6.94688 8.90963 numMergedOcc 0
54 mol 181 unq 7 iso 0 dist 9.6668 11.6919 9.40622 9.34211 5.95304 6.03415 9.15386 8.25067 6.71012 8.90963 numMergedOcc 0
55 mol 227 unq 0 iso 0 dist 8.17891 13.3557 7.95168 10.9607 7.57454 9.75331 7.22101 6.43754 12.3856 5.41321 numMergedOcc 0
56 mol 227 unq 1 iso 0 dist 6.95902 8.8709 7.95168 9.72615 7.57454 9.75331 8.65997 6.43754 12.3856 5.41321 numMergedOcc 0
57 mol 234 unq 0 iso 0 dist 9.5707 5.56749 8.49841 10.0059 7.43663 7.17691 10.3625 5.9221 6.16063 7.32499 numMergedOcc 0
58 mol 234 unq 1 iso 0 dist 9.5707 12.1076 9.6101 10.0059 7.43663 4.51304 10.3625 5.9221 11.4691 7.32499 numMergedOcc 0
59 mol 234 unq 2 iso 0 dist 9.39181 6.29366 5.32183 5.08515 7.94068 4.51304 11.0622 13.2297 11.4691 7.32499 numMergedOcc 0
60 mol 235 unq 0 iso 0 dist 8.21247 10.6981 7.27958 7.60081 7.95766 4.29892 5.4638 4.65302 10.7117 9.55668 numMergedOcc 0
61 mol 235 unq 1 iso 0 dist 8.21247 10.6981 7.27958 7.60081 7.95766 4.29892 11.3258 6.43692 5.65339 6.95126 numMergedOcc 0
62 mol 238 unq 0 iso 0 dist 8.14172 5.68826 6.00721 12.2874 8.90076 13.3255 12.8275 5.11565 10.924 7.57812 numMergedOcc 0
63 mol 238 unq 1 iso 0 dist 8.14172 5.68826 6.00721 12.2874 8.90076 13.3255 15.1497 11.0401 13.368 9.24557 numMergedOcc 0
64 mol 238 unq 2 iso 0 dist 8.14172 5.68826 6.00721 7.11984 6.62002 9.71156 12.8275 5.11565 10.924 8.69104 numMergedOcc 0
65 mol 238 unq 3 iso 0 dist 6.77463 4.87097 6.00721 10.4017 8.90076 13.3255 10.7456 5.11565 10.924 7.57812 numMergedOcc 0
66 mol 238 unq 4 iso 0 dist 6.77463 4.87097 6.00721 10.4017 8.90076 13.3255 10.3007 11.0401 13.368 9.24557 numMergedOcc 0
67 mol 238 unq 5 iso 0 dist 6.77463 4.87097 6.00721 7.95232 6.62002 9.71156 10.7456 5.11565 10.924 8.69104 numMergedOcc 0
