0 mol 0 unq 0 iso 0 dist 9.23213 8.81979 9.14029 6.26831 4.04089 7.56754 numMergedOcc 0
1 mol 0 unq 0 iso 1 dist 8.81979 9.23213 9.14029 6.26831 7.56754 4.04089 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 6.85412 6.33889 5.80437 9.78006 7.98363 10.4204 numMergedOcc 0
3 mol 9 unq 0 iso 1 dist 6.33889 6.85412 5.80437 9.78006 10.4204 7.98363 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.78293 8.23643 12.7954 6.92532 15.1136 6.87842 numMergedOcc 0
5 mol 19 unq 0 iso 1 dist 8.23643 8.78293 12.7954 6.92532 6.87842 15.1136 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 8.78293 7.82528 14.7664 6.92532 15.1136 6.34272 numMergedOcc 0
7 mol 19 unq 1 iso 1 dist 7.82528 8.78293 14.7664 6.92532 6.34272 15.1136 numMergedOcc 0
8 mol 19 unq 1 iso 0 dist 8.23643 7.82528 11.0033 6.92532 6.87842 6.34272 numMergedOcc 0
9 mol 19 unq 1 iso 1 dist 7.82528 8.23643 11.0033 6.92532 6.34272 6.87842 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 6.46761 7.58407 6.44201 7.27383 9.17656 10.8775 numMergedOcc 0
11 mol 58 unq 0 iso 1 dist 7.58407 6.46761 6.44201 7.27383 10.8775 9.17656 numMergedOcc 0
12 mol 70 unq 0 iso 0 dist 7.92394 9.93423 4.25121 6.54023 11.6542 11.7156 numMergedOcc 0
13 mol 70 unq 0 iso 1 dist 9.93423 7.92394 4.25121 6.54023 11.7156 11.6542 numMergedOcc 0
14 mol 70 unq 1 iso 0 dist 7.92394 9.34122 13.6636 6.54023 11.6542 4.95817 numMergedOcc 0
15 mol 70 unq 1 iso 1 dist 9.34122 7.92394 13.6636 6.54023 4.95817 11.6542 numMergedOcc 0
16 mol 70 unq 1 iso 0 dist 9.93423 9.34122 12.434 6.54023 11.7156 4.95817 numMergedOcc 0
17 mol 70 unq 1 iso 1 dist 9.34122 9.93423 12.434 6.54023 4.95817 11.7156 numMergedOcc 0
18 mol 76 unq 0 iso 0 dist 8.97793 8.19682 5.67347 4.79949 6.81799 8.83525 numMergedOcc 0
19 mol 76 unq 0 iso 1 dist 8.19682 8.97793 5.67347 4.79949 8.83525 6.81799 numMergedOcc 0
20 mol 76 unq 1 iso 0 dist 8.97793 8.19682 5.67347 7.27693 6.42322 5.77727 numMergedOcc 0
21 mol 76 unq 1 iso 1 dist 8.19682 8.97793 5.67347 7.27693 5.77727 6.42322 numMergedOcc 0
22 mol 115 unq 0 iso 0 dist 6.99777 9.14376 11.889 5.74857 6.03931 5.99374 numMergedOcc 0
23 mol 115 unq 0 iso 1 dist 9.14376 6.99777 11.889 5.74857 5.99374 6.03931 numMergedOcc 0
24 mol 124 unq 0 iso 0 dist 6.83051 9.28376 4.81682 8.58188 8.52488 5.93612 numMergedOcc 0
25 mol 124 unq 0 iso 1 dist 9.28376 6.83051 4.81682 8.58188 5.93612 8.52488 numMergedOcc 0
26 mol 131 unq 0 iso 0 dist 6.91348 9.51418 10.2027 9.29384 6.01893 15.1974 numMergedOcc 0
27 mol 131 unq 0 iso 1 dist 9.51418 6.91348 10.2027 9.29384 15.1974 6.01893 numMergedOcc 0
28 mol 181 unq 0 iso 0 dist 6.94688 6.71012 5.3528 6.51749 10.4684 12.69 numMergedOcc 0
29 mol 181 unq 0 iso 1 dist 6.71012 6.94688 5.3528 6.51749 12.69 10.4684 numMergedOcc 0
30 mol 194 unq 0 iso 0 dist 5.48258 6.15769 7.46053 8.83356 7.69247 13.9521 numMergedOcc 0
31 mol 194 unq 0 iso 1 dist 6.15769 5.48258 7.46053 8.83356 13.9521 7.69247 numMergedOcc 0
32 mol 195 unq 0 iso 0 dist 8.36117 6.77578 5.42587 7.62942 9.08602 8.18628 numMergedOcc 0
33 mol 195 unq 0 iso 1 dist 6.77578 8.36117 5.42587 7.62942 8.18628 9.08602 numMergedOcc 0
34 mol 214 unq 0 iso 0 dist 6.97182 6.1175 5.93129 6.38157 9.26037 11.353 numMergedOcc 0
35 mol 214 unq 0 iso 1 dist 6.1175 6.97182 5.93129 6.38157 11.353 9.26037 numMergedOcc 0
36 mol 220 unq 0 iso 0 dist 6.84247 6.99002 11.5311 5.45036 5.49803 11.2241 numMergedOcc 0
37 mol 220 unq 0 iso 1 dist 6.99002 6.84247 11.5311 5.45036 11.2241 5.49803 numMergedOcc 0
38 mol 220 unq 1 iso 0 dist 6.84247 6.99002 11.5311 9.97586 7.44322 9.68359 numMergedOcc 0
39 mol 220 unq 1 iso 1 dist 6.99002 6.84247 11.5311 9.97586 9.68359 7.44322 numMergedOcc 0
40 mol 227 unq 0 iso 0 dist 9.62609 6.95902 8.55671 5.4694 5.23507 5.92529 numMergedOcc 0
41 mol 227 unq 0 iso 1 dist 6.95902 9.62609 8.55671 5.4694 5.92529 5.23507 numMergedOcc 0
42 mol 234 unq 0 iso 0 dist 9.5707 7.85175 5.32617 7.5366 16.5499 13.0974 numMergedOcc 0
43 mol 234 unq 0 iso 1 dist 7.85175 9.5707 5.32617 7.5366 13.0974 16.5499 numMergedOcc 0
44 mol 238 unq 0 iso 0 dist 9.68513 5.9216 4.83721 6.4398 6.48619 5.8333 numMergedOcc 0
45 mol 238 unq 0 iso 1 dist 5.9216 9.68513 4.83721 6.4398 5.8333 6.48619 numMergedOcc 0
46 mol 240 unq 0 iso 0 dist 6.15305 8.0951 11.0721 9.47583 9.75032 12.9871 numMergedOcc 0
47 mol 240 unq 0 iso 1 dist 8.0951 6.15305 11.0721 9.47583 12.9871 9.75032 numMergedOcc 0
48 mol 259 unq 0 iso 0 dist 6.77938 7.76676 6.1415 8.59697 12.1218 9.22203 numMergedOcc 0
49 mol 259 unq 0 iso 1 dist 7.76676 6.77938 6.1415 8.59697 9.22203 12.1218 numMergedOcc 0
50 mol 272 unq 0 iso 0 dist 9.09992 6.16449 9.75529 9.19033 11.8912 6.56154 numMergedOcc 0
51 mol 272 unq 0 iso 1 dist 6.16449 9.09992 9.75529 9.19033 6.56154 11.8912 numMergedOcc 0
