0 mol 5 unq 0 iso 0 dist 6.96805 11.6519 9.45559 12.0161 7.4332 4.84696 numMergedOcc 0
1 mol 5 unq 0 iso 1 dist 6.96805 12.0161 7.4332 11.6519 9.45559 4.84696 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 5.73908 7.27578 5.26566 5.66182 6.27118 5.34678 numMergedOcc 0
3 mol 68 unq 0 iso 1 dist 5.73908 5.66182 6.27118 7.27578 5.26566 5.34678 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.09675 11.1342 9.85386 8.22845 4.8983 11.6321 numMergedOcc 0
5 mol 73 unq 0 iso 1 dist 8.09675 8.22845 4.8983 11.1342 9.85386 11.6321 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.02753 10.0544 9.85386 6.96897 4.8983 11.6321 numMergedOcc 0
7 mol 73 unq 1 iso 1 dist 9.02753 6.96897 4.8983 10.0544 9.85386 11.6321 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 8.01516 12.5904 6.65972 7.80434 4.2253 5.63083 numMergedOcc 0
9 mol 79 unq 0 iso 1 dist 8.01516 7.80434 4.2253 12.5904 6.65972 5.63083 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 7.13958 3.54691 4.4077 5.56761 8.4874 5.83342 numMergedOcc 0
11 mol 129 unq 0 iso 1 dist 7.13958 5.56761 8.4874 3.54691 4.4077 5.83342 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 9.28415 15.6885 9.57243 7.06015 8.12558 13.315 numMergedOcc 0
13 mol 141 unq 0 iso 1 dist 9.28415 7.06015 8.12558 15.6885 9.57243 13.315 numMergedOcc 0
14 mol 165 unq 0 iso 0 dist 9.8446 3.36546 9.98689 14.9166 5.93144 15.5252 numMergedOcc 0
15 mol 165 unq 0 iso 1 dist 9.8446 14.9166 5.93144 3.36546 9.98689 15.5252 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.32641 4.77079 7.90621 7.71219 8.0943 4.62459 numMergedOcc 0
17 mol 186 unq 0 iso 1 dist 8.32641 7.71219 8.0943 4.77079 7.90621 4.62459 numMergedOcc 0
18 mol 207 unq 0 iso 0 dist 8.27274 8.59463 5.77532 9.91526 8.75785 5.27291 numMergedOcc 0
19 mol 207 unq 0 iso 1 dist 8.27274 9.91526 8.75785 8.59463 5.77532 5.27291 numMergedOcc 0
20 mol 211 unq 0 iso 0 dist 9.26542 6.3032 5.49212 6.17106 9.79135 5.04634 numMergedOcc 0
21 mol 211 unq 0 iso 1 dist 9.26542 6.17106 9.79135 6.3032 5.49212 5.04634 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 5.17988 3.67192 7.02613 10.2653 8.95185 13.3862 numMergedOcc 0
23 mol 254 unq 0 iso 1 dist 5.17988 10.2653 8.95185 3.67192 7.02613 13.3862 numMergedOcc 0
24 mol 254 unq 1 iso 0 dist 8.76115 12.9566 8.30975 10.5182 8.10036 4.12416 numMergedOcc 0
25 mol 254 unq 1 iso 1 dist 8.76115 10.5182 8.10036 12.9566 8.30975 4.12416 numMergedOcc 0
26 mol 254 unq 2 iso 0 dist 8.76115 12.9566 8.30975 10.2653 8.96529 14.2091 numMergedOcc 0
27 mol 254 unq 2 iso 1 dist 8.76115 10.2653 8.96529 12.9566 8.30975 14.2091 numMergedOcc 0
28 mol 254 unq 2 iso 0 dist 8.76115 10.5182 8.10036 10.2653 8.96529 11.5654 numMergedOcc 0
29 mol 254 unq 2 iso 1 dist 8.76115 10.2653 8.96529 10.5182 8.10036 11.5654 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 6.70414 7.31817 4.1545 3.91224 4.25172 3.41319 numMergedOcc 0
31 mol 277 unq 0 iso 1 dist 6.70414 3.91224 4.25172 7.31817 4.1545 3.41319 numMergedOcc 0
32 mol 285 unq 0 iso 0 dist 5.76796 10.1123 7.08681 7.01472 4.95596 11.9982 numMergedOcc 0
33 mol 285 unq 0 iso 1 dist 5.76796 7.01472 4.95596 10.1123 7.08681 11.9982 numMergedOcc 0
34 mol 285 unq 1 iso 0 dist 5.76796 10.1123 7.08681 11.0045 6.3508 11.9803 numMergedOcc 0
35 mol 285 unq 1 iso 1 dist 5.76796 11.0045 6.3508 10.1123 7.08681 11.9803 numMergedOcc 0
36 mol 285 unq 2 iso 0 dist 5.76796 10.1123 7.08681 8.2602 8.3005 14.1264 numMergedOcc 0
37 mol 285 unq 2 iso 1 dist 5.76796 8.2602 8.3005 10.1123 7.08681 14.1264 numMergedOcc 0
38 mol 285 unq 1 iso 0 dist 5.76796 7.01472 4.95596 11.0045 6.3508 4.87372 numMergedOcc 0
39 mol 285 unq 1 iso 1 dist 5.76796 11.0045 6.3508 7.01472 4.95596 4.87372 numMergedOcc 0
40 mol 285 unq 2 iso 0 dist 5.76796 7.01472 4.95596 8.2602 8.3005 6.95388 numMergedOcc 0
41 mol 285 unq 2 iso 1 dist 5.76796 8.2602 8.3005 7.01472 4.95596 6.95388 numMergedOcc 0
42 mol 285 unq 2 iso 0 dist 5.76796 11.0045 6.3508 8.2602 8.3005 9.46838 numMergedOcc 0
43 mol 285 unq 2 iso 1 dist 5.76796 8.2602 8.3005 11.0045 6.3508 9.46838 numMergedOcc 0
